SCHEMBL5032444

SCHEMBL5032444

c1cncc(-c2nc(-c3cccnc3)nc(-c3cccnc3)n2)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.73
ALDH1A1 P00352 4/20 0.73
TP53 P04637 3/20 0.73
HSD17B10 Q99714 3/20 0.73
MAPT P10636 3/20 0.73
KDM4E B2RXH2 2/20 0.73
HPGD P15428 2/20 0.73
LMNA P02545 1/20 0.73
ALOX15 P16050 1/20 0.73
HTT P42858 1/20 0.73
CYP2A6 P11509 6/20 0.70
CYP1A2 P05177 3/20 0.70
CYP3A4 P08684 3/20 0.70
CHRNB2 P17787 1/20 0.61
CHRNA5 P30532 1/20 0.61
CHRNA4 P43681 1/20 0.61
CYP19A1 P11511 3/20 0.59
TSHR P16473 2/20 0.55
NPSR1 Q6W5P4 2/20 0.55
NPC1 O15118 1/20 0.53

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
SCHEMBL29543568 1.00 SMN1; SMN2 (0.73) SMN1; SMN2ALDH1A1TP53HSD17B10MAPT
SCHEMBL9975322 0.95 SMN1; SMN2 (0.67) SMN1; SMN2ALDH1A1TP53HSD17B10MAPT
SCHEMBL5590272 0.93 ALDH1A1 (0.64) SMN1; SMN2ALDH1A1TP53HSD17B10MAPT
SCHEMBL5590400 0.93 ALDH1A1 (0.64) SMN1; SMN2ALDH1A1TP53HSD17B10MAPT
SCHEMBL9920519 0.91 ALDH1A1 (0.61) SMN1; SMN2ALDH1A1TP53HSD17B10MAPT
SCHEMBL23092286 0.89 SMN1; SMN2 (0.70) SMN1; SMN2ALDH1A1TP53HSD17B10MAPT
SCHEMBL17486128 0.89 ALDH1A1 (0.59) SMN1; SMN2ALDH1A1TP53HSD17B10MAPT
SCHEMBL15046261 0.89 SMN1; SMN2 (0.59) SMN1; SMN2ALDH1A1TP53HSD17B10MAPT
SCHEMBL22537957 0.89 SMN1; SMN2 (0.59) SMN1; SMN2ALDH1A1TP53HSD17B10MAPT
SCHEMBL12551646 0.87 ALDH1A1 (0.57) SMN1; SMN2ALDH1A1TP53HSD17B10MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12629639-B2 Spacer for a spiral wound membrane EVOVE LTD (GB) 2026-05-19 US disclosed
EP-4722699-A1 SAMPLE FOR CRYSTAL STRUCTURE ANALYSIS, SAMPLE PRECURSOR FOR CRYSTAL STRUCTURE ANALYSIS, METHOD FOR PRODUCING SAMPLE FOR CRYSTAL STRUCTURE ANALYSIS, AND SAMPLE PREPARATION KIT FOR CRYSTAL STRUCTURE ANALYSIS The University of Tokyo (JP) 2026-04-08 EP disclosed
US-12317743-B2 N-type semiconductor, and organic photoelectric device, image sensor, and electronic device including the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2025-05-27 US disclosed
WO-2024248036-A1 SAMPLE FOR CRYSTAL STRUCTURE ANALYSIS, SAMPLE PRECURSOR FOR CRYSTAL STRUCTURE ANALYSIS, METHOD FOR PRODUCING SAMPLE FOR CRYSTAL STRUCTURE ANALYSIS, AND SAMPLE PREPARATION KIT FOR CRYSTAL STRUCTURE ANALYSIS 国立大学法人東京大学 2024-12-05 WO disclosed
EP-4397399-A2 MEMBRANES COMPRISING A LAYER OF METAL ORGANIC FRAMEWORK PARTICLES G2O Water Technologies Limited (GB) 2024-07-10 EP disclosed
US-20240157304-A1 SPACER FOR A SPIRAL WOUND MEMBRANE EVOVE LTD (GB) 2024-05-16 US disclosed
US-20240149223-A1 MEMBRANE DEVICE EVOVE LTD (GB) 2024-05-09 US disclosed
EP-4304765-A1 SPACER FOR A SPIRAL WOUND MEMBRANE Evove Ltd (GB) 2024-01-17 EP disclosed
EP-4304766-A1 MEMBRANE DEVICE Evove Ltd (GB) 2024-01-17 EP disclosed
US-11815475-B2 Method for identifying molecular structure THE UNIVERSITY OF TOKYO (JP) 2023-11-14 US disclosed
US-20130146073-A1 SPRAY AND/OR SOIL TREATMENT OF TOBACCO TO REDUCE TSNAs PHILIP MORRIS USA INC. (US) 2013-06-13 US disclosed
US-8353300-B2 Sodium chloride spray treatment of soil surrounding tobacco plants to reduce TSNAs PHILIP MORRIS USA INC. (US) 2013-01-15 US disclosed
US-20080202538-A1 SPRAY AND/OR SOIL TREATMENT OF TOBACCO TO REDUCE TSNAs PHILIP MORRIS USA INC. (US) 2008-08-28 US disclosed
WO-2008025941-A2 COMPOUNDS FOR IMAGING AND THERAPY ISIS INNOVATION LIMITED (GB) 2008-03-06 WO disclosed
US-20070020519-A1 Anode active material, manufacturing method thereof and lithium battery using the anode active material SAMSUNG SDI CO., LTD. (KR) 2007-01-25 US disclosed
US-20050034365-A1 Spray and/or soil treatment of tobacco to reduce TSNAs PHILIP MORRIS USA INC. 2005-02-17 US disclosed
WO-2004068973-A2 SPRAY AND/OR SOIL TREATMENT OF TOBACCO TO REDUCE TSNAS PHILIP MORRIS PRODUCTS S.A. (CH) 2004-08-19 WO disclosed
WO-2002014254-A1 PROCESS FOR PRODUCING KETONE BY OXIDATIVE DECOMPOSITION OF OLEFIN JAPAN SCIENCE AND TECHNOLOGY CORPORATION (JP) 2002-02-21 WO disclosed
JP-2002053516-A METHOD OF PRODUCING KETONE BY OXIDATIVE DEGRADATION OF OLEFIN JAPAN SCIENCE & TECHNOLOGY CORP 2002-02-19 JP disclosed
US-5190870-A Method for oxidizing hydrocarbons with a hydroxylase from a methane monooxygenase AMOCO CORPORATION (US) 1993-03-02 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 (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-12629639-B2 Spacer for a spiral wound membrane AQP1, AQP3, AQP4 SMN1; SMN2 3946/4885ALDH1A1 1090/4885TP53 1222/4885
US-12317743-B2 N-type semiconductor, and organic photoelectric device, image sensor, and electronic device including the same NCS1, SCN1A, SCN1B SMN1; SMN2 2241/4885ALDH1A1 1311/4885TP53 2377/4885

“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.