SCHEMBL29976332

SCHEMBL29976332

BrCc1ccc2scnc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.47
HSD17B10 Q99714 1/20 0.47
TRPM5 Q9NZQ8 1/20 0.38
FFAR1 O14842 1/20 0.38
HSD11B1 P28845 1/20 0.38
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
KDM4E B2RXH2 1/20 0.37
HKDC1 Q2TB90 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PTK6 Q13882 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
NAMPT P43490 1/20 0.35
MAPK1 P28482 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
DYRK1A Q13627 1/20 0.35
RIPK2 O43353 3/20 0.35

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
SCHEMBL9676880 1.00 ALDH1A1 (0.47) ALDH1A1HSD17B10TRPM5FFAR1HSD11B1
SCHEMBL27278065 0.87 ALDH1A1 (0.42) ALDH1A1HSD17B10TRPM5FFAR1HSD11B1
SCHEMBL506591 0.84 NPC1 (0.49) ALDH1A1HSD17B10NPC1RAB9AKDM4E
SCHEMBL3819546 0.82 ALDH1A1 (0.45) ALDH1A1HSD17B10TRPM5FFAR1HSD11B1
SCHEMBL9921443 0.82 ALDH1A1 (0.45) ALDH1A1HSD17B10TRPM5FFAR1HSD11B1
SCHEMBL6396893 0.82 CYP2A6 (0.47) ALDH1A1HSD17B10TRPM5FFAR1HSD11B1
SCHEMBL13610284 0.82 ALDH1A1 (0.45) ALDH1A1HSD17B10TRPM5FFAR1HSD11B1
SCHEMBL2357662 0.82 HSD17B10 (0.50) ALDH1A1HSD17B10TRPM5FFAR1HSD11B1
SCHEMBL2620993 0.82 NPC1 (0.47) ALDH1A1HSD17B10TRPM5FFAR1HSD11B1
SCHEMBL27281640 0.82 ALDH1A1 (0.41) ALDH1A1HSD17B10TRPM5FFAR1HSD11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4638436-A1 PRMT5 INHIBITORS AND USES THEREOF GILEAD SCIENCES, INC. (US) 2025-10-29 EP disclosed
CN-118047780-A Quinazoline heterocyclic compound and anti-infection and anti-tumor application thereof 中国医学科学院药物研究所 2024-05-17 CN disclosed
CN-110023292-B Apoptosis inhibitors 北京生命科学研究所 2022-10-04 CN disclosed