SCHEMBL6346307

SCHEMBL6346307

Ic1cccc(Nc2ccccc2)c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.68
MAPT P10636 5/20 0.68
MEN1 O00255 4/20 0.68
KMT2A Q03164 4/20 0.68
AR P10275 1/20 0.68
HSD17B10 Q99714 4/20 0.57
TDP1 Q9NUW8 5/20 0.56
CYP3A4 P08684 4/20 0.56
TSHR P16473 3/20 0.56
KDM4E B2RXH2 3/20 0.56
GAA P10253 2/20 0.56
LMNA P02545 2/20 0.56
GFER P55789 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
ALOX12 P18054 3/20 0.55
L3MBTL1 Q9Y468 3/20 0.55
ALOX15 P16050 2/20 0.55
PTGS1 P23219 1/20 0.55
SLC6A2 P23975 1/20 0.55
MAPK1 P28482 1/20 0.55

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
SCHEMBL1686500 0.93 MEN1 (0.55) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL25692156 0.83 ALDH1A1 (0.46) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL32665149 0.83 CYP3A4 (0.53) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL678299 0.82 ALDH1A1 (1.00) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL16621392 0.81 AKR1C3 (0.53) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL32665516 0.78 RAB9A (0.61) ALDH1A1MAPTMEN1KMT2ATDP1
SCHEMBL8795249 0.77 SIGMAR1 (0.46) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL9440409 0.77 ALDH1A1 (0.72) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL24137804 0.76 MAPT (0.52) ALDH1A1MAPTMEN1KMT2AAR
SCHEMBL7298939 0.76 MAPT (0.62) ALDH1A1MAPTMEN1KMT2AHSD17B10

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109422770-B Boron-containing heterocyclic compounds for OLEDs, organic light emitting devices, and compound formulations comprising the same 北京夏禾科技有限公司 2022-03-11 CN disclosed
US-10998506-B2 Boron containing heterocyclic compound for OLEDs, an organic light-emitting device, and a formulation comprising the boron-containing heterocyclic compound Beijing Summer Sprout Technology Co., Ltd. (CN) 2021-05-04 US disclosed
US-10998506-B2 Boron containing heterocyclic compound for OLEDs, an organic light-emitting device, and a formulation comprising the boron-containing heterocyclic compound Beijing Summer Sprout Technology Co., Ltd. (CN) 2021-05-04 US disclosed
US-6914122-B2 Macrocyclic NS-3 serine protease inhibitors of hepatitis C virus comprising alkyl and aryl alanine P2 moieties SCHERING CORPORATION (US) 2005-07-05 US disclosed
EP-1274724-A2 MACROCYCLIC NS3-SERINE PROTEASE INHIBITORS OF HEPATITIS C VIRUS COMPRISING ALKYL AND ARYL ALANINE P2 MOIETIES SCHERING CORPORATION (US) 2003-01-15 EP disclosed
US-20020016294-A1 Macrocyclic NS-3 serine protease inhibitors of hepatitis C virus comprising alkyl and aryl alanine P2 moieties SCHERING CORPORATION 2002-02-07 US disclosed
WO-2001081325-A2 MACROCYCLIC NS3-SERINE PROTEASE INHIBITORS OF HEPATITIS C VIRUS COMPRISING ALKYL AND ARYL ALANINE P2 MOIETIES SCHERING CORPORATION (US) 2001-11-01 WO 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 (2 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-10998506-B2 Boron containing heterocyclic compound for OLEDs, an organic light-emitting device, and a formulation comprising the boron-containing heterocyclic compound OCIAD2, OCIAD1, SBDS ALDH1A1 2620/4885MAPT 899/4885MEN1 2469/4885
US-20020016294-A1 Macrocyclic NS-3 serine protease inhibitors of hepatitis C virus comprising alkyl and aryl alanine P2 moieties PRSS3, HPN, DPP3 ALDH1A1 3217/4885MAPT 4377/4885MEN1 4509/4885

“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.