SCHEMBL31663480

SCHEMBL31663480

Oc1ccnc(-c2ncccc2-c2ccccn2)c1-c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.39
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KDM4E B2RXH2 2/20 0.37
CYP1A2 P05177 1/20 0.37
POLB P06746 1/20 0.37
CCR1 P32246 1/20 0.37
CCR5 P51681 1/20 0.37
CCR8 P51685 1/20 0.37
METAP1 P53582 1/20 0.37
BLM P54132 1/20 0.37
HIF1A Q16665 1/20 0.37
DOHH Q9BU89 1/20 0.37
P4HTM Q9NXG6 1/20 0.37
TGFBR1 P36897 2/20 0.37
CASP6 P55212 1/20 0.37
TDP2 O95551 1/20 0.36

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
SCHEMBL6384277 0.88 TGFBR1 (0.39) CYP2A6NPC1RAB9ALMNAMAPT
SCHEMBL31187041 0.82 CYP2A6 (0.39) CYP2A6NPC1RAB9ALMNAMAPT
SCHEMBL8546751 0.81 KDM4E (0.42) NPC1RAB9ALMNAL3MBTL1KDM4E
SCHEMBL31563654 0.79 KDM4E (0.46) NPC1RAB9ALMNAMAPTL3MBTL1
SCHEMBL30144092 0.79 KDM4E (0.46) NPC1RAB9ALMNAMAPTL3MBTL1
SCHEMBL26570373 0.79 KDM4E (0.50) CYP2A6NPC1RAB9ALMNAL3MBTL1
Boric Acid SCHEMBL30023657 0.78 PTGS1 (0.44) CYP2A6NPC1RAB9ALMNAMAPT
SCHEMBL28552348 0.78 LMNA (0.42) CYP2A6NPC1RAB9ALMNAMAPT
Biphenyl SCHEMBL1363812 0.77 CYP2A6 (0.48) CYP2A6NPC1RAB9ALMNAMAPT
SCHEMBL5570307 0.77 HTR2B (0.40) NPC1RAB9ALMNAMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120350484-A High-temperature-resistant woven belt and preparation method thereof 江苏欣晨雅新材料有限公司 2025-07-22 CN disclosed