SCHEMBL4547699

SCHEMBL4547699

C/N=C(\C)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
MAPK1 P28482 1/20 0.52
HTT P42858 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
CYP1A2 P05177 2/20 0.50
CYP2D6 P10635 1/20 0.50
HSD17B10 Q99714 1/20 0.50
POLB P06746 1/20 0.50
MAPT P10636 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.48
ALDH1A1 P00352 2/20 0.47
ATM Q13315 2/20 0.47
METTL3 Q86U44 1/20 0.47
G6PC1 P35575 1/20 0.47
GAA P10253 2/20 0.45
NPSR1 Q6W5P4 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
CES2 O00748 2/20 0.44
CES1 P23141 2/20 0.44
MEN1 O00255 3/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3443700 1.00 LMNA (0.52) LMNAMAPK1HTTL3MBTL1CYP1A2
SCHEMBL3443698 1.00 LMNA (0.52) LMNAMAPK1HTTL3MBTL1CYP1A2
SCHEMBL10150702 0.85 SMN1; SMN2 (0.56) L3MBTL1CYP1A2CYP2D6HSD17B10POLB
SCHEMBL14274487 0.85 FURIN (0.48) LMNAMAPK1HTTL3MBTL1CYP1A2
SCHEMBL22212833 0.80 FURIN (0.52) POLBMAPTSMN1; SMN2ALDH1A1NPC1
SCHEMBL7968589 0.80 FURIN (0.56) LMNAMAPK1HTTL3MBTL1CYP1A2
SCHEMBL4279968 0.80 FURIN (0.56) LMNAMAPK1HTTL3MBTL1CYP1A2
SCHEMBL4037961 0.80 FURIN (0.56) LMNAMAPK1HTTL3MBTL1CYP1A2
SCHEMBL45278 0.78 LMNA (0.52) LMNAMAPK1HTTL3MBTL1CYP1A2
SCHEMBL2736631 0.78 LMNA (0.52) LMNAMAPK1HTTL3MBTL1CYP1A2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11864458-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2024-01-02 US disclosed
US-20230276693-A1 LIGHT-EMITTING DEVICE, ELECTRONIC APPARATUS INCLUDING THE LIGHT-EMITTING DEVICE, AND MIXTURE SAMSUNG DISPLAY CO., LTD. (KR) 2023-08-31 US disclosed
EP-3227018-B1 CHELATION DIRECTED C-H ACTIVATION REACTIONS CATALYZED BY SOLID-SUPPORTED PALLADIUM(II) CATALYSTS UNIV VIRGINIA COMMONWEALTH (US) 2021-06-30 EP disclosed
US-20210104690-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2021-04-08 US disclosed
WO-2021052921-A1 MIXTURE OF TWO HOST MATERIALS, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME MERCK PATENT GMBH (DE) 2021-03-25 WO disclosed
WO-2020028396-A1 CHIRALITY SENSING WITH MOLECULAR CLICK CHEMISTRY PROBES GEORGETOWN UNIVERSITY (US) 2020-02-06 WO disclosed
WO-2019148851-A1 FIVE-MEMBERED RING-SUBSTITUTED PYRIDAZINOL COMPOUND AND DERIVATIVES THEREOF, PREPARATION METHOD, HERBICIDAL COMPOSITION, AND APPLICATION 青岛清原化合物有限公司 2019-08-08 WO disclosed
WO-2019149260-A1 PYRIDAZINOL COMPOUND, DERIVATIVE THEREOF, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF 青岛清原化合物有限公司 2019-08-08 WO disclosed
US-10000453-B2 Chelation directed C—H activation reactions catalyzed by solid-supported palladium(II) catalysts VIRGINIA COMMONWEALTH UNIVERSITY (US) 2018-06-19 US disclosed
US-20170362181-A1 CHELATION DIRECTED C-H ACTIVATION REACTIONS CATALYZED BY SOLID-SUPPORTED PALLADIUM(II) CATALYSTS VIRGINIA COMMONWEALTH UNIVERSITY 2017-12-21 US disclosed
US-7671212-B2 Isothiazole dioxides as CXC- and CC-chemokine receptor ligands SCHERING CORPORATION (US) 2010-03-02 US disclosed
US-20090318497-A1 SUBSTITUTED PYRIDYLMETHYL BICYCLICCARBOXYAMIDE COMPOUNDS PFIZER, INC. 2009-12-24 US disclosed
US-20090306079-A1 3,4-DI-SUBSTITUTED CYCLOBUTENE-1,2-DIONES AS CXC-CHEMOKINE RECEPTOR LIGANDS SCHERING CORPORATION 2009-12-10 US disclosed
US-20090203927-A1 Homogeneous asymmetric hydrogenation catalyst TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-08-13 US disclosed
US-20080090823-A1 THIADIAZOLES AS CXC- AND CC- CHEMOKINE RECEPTOR LIGANDS MERCK SHARP & DOHME CORP. 2008-04-17 US disclosed
US-7312347-B2 Substituted optically active disphosphine compound TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-12-25 US disclosed
US-20070293681-A1 Asymmetric Imine Hydrogenation Processes ABDUR-RASHID KAMALUDDIN 2007-12-20 US disclosed
US-20070293681-A1 Asymmetric Imine Hydrogenation Processes ABDUR-RASHID KAMALUDDIN 2007-12-20 US disclosed
WO-2007075468-A1 SUBSTITUTED IMIDAZOQUINOLINES, IMIDAZONAPHTHYRIDINES, AND IMIDAZOPYRIDINES, COMPOSITIONS, AND METHODS COLEY PHARMACEUTICAL GROUP, INC. (US) 2007-07-05 WO disclosed
US-20070073065-A1 Substituted optically active disphosphine compound TAKASAGO INTERNATIONAL CORPORATION (JP) 2007-03-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080090823-A1 THIADIAZOLES AS CXC- AND CC- CHEMOKINE RECEPTOR LIGANDS CCR2, ACKR3, CX3CR1 LMNA 4727/4885MAPK1 1486/4885HTT 3780/4885
US-20090203927-A1 Homogeneous asymmetric hydrogenation catalyst HDHD5, HHAT, HACL2 LMNA 4665/4885MAPK1 3255/4885HTT 487/4885
US-20170362181-A1 CHELATION DIRECTED C-H ACTIVATION REACTIONS CATALYZED BY SOLID-SUPPORTED PALLADIUM(II) CATALYSTS WASF2, SCO2, SOD1 LMNA 3565/4885MAPK1 1610/4885HTT 821/4885
US-11864458-B2 Organic electroluminescent materials and devices RAP1A, L1CAM, SOD1 LMNA 1300/4885MAPK1 1193/4885HTT 3280/4885
US-10000453-B2 Chelation directed C—H activation reactions catalyzed by solid-supported palladium(II) catalysts WASF2, SOD1, CD274 LMNA 3454/4885MAPK1 1600/4885HTT 746/4885
US-20090318497-A1 SUBSTITUTED PYRIDYLMETHYL BICYCLICCARBOXYAMIDE COMPOUNDS CNR1, CNR2, HCAR3 LMNA 2168/4885MAPK1 1218/4885HTT 857/4885
US-20070073065-A1 Substituted optically active disphosphine compound DHPS, DOHH, DHODH LMNA 4855/4885MAPK1 1901/4885HTT 3862/4885
US-20070293681-A1 Asymmetric Imine Hydrogenation Processes HRH3, HRH1, HRH4 LMNA 4266/4885MAPK1 1287/4885HTT 2367/4885
US-20210104690-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES RAP1A, L1CAM, SOD1 LMNA 1300/4885MAPK1 1193/4885HTT 3280/4885
US-20090306079-A1 3,4-DI-SUBSTITUTED CYCLOBUTENE-1,2-DIONES AS CXC-CHEMOKINE RECEPTOR LIGANDS CCR1, ACKR3, CXCR1 LMNA 4778/4885MAPK1 661/4885HTT 4806/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.