SCHEMBL10508644

SCHEMBL10508644

Cn1ncc(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.53
PTGIR P43119 2/20 0.47
CREBBP Q92793 1/20 0.47
PDE2A O00408 3/20 0.47
PRMT5 O14744 1/20 0.47
WDR77 Q9BQA1 1/20 0.47
PTGS2 P35354 1/20 0.46
NPC1 O15118 4/20 0.44
RAB9A P51151 4/20 0.44
LPAR1 Q92633 1/20 0.42
PDE10A Q9Y233 3/20 0.41
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
MAPT P10636 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41

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
SCHEMBL8138943 0.82 KDR (0.48) HIF1ACREBBPPDE2APRMT5WDR77
SCHEMBL9911757 0.81 PTGS2 (0.46) HIF1APTGIRCREBBPPDE2APRMT5
SCHEMBL12175373 0.81 CREBBP (0.62) HIF1ACREBBPPTGS2NPC1RAB9A
SCHEMBL23402261 0.79 HIF1A (0.42) HIF1APTGIRCREBBPPDE2APRMT5
SCHEMBL14937976 0.79 HIF1A (0.42) HIF1APTGIRCREBBPPDE2APRMT5
SCHEMBL16110414 0.79 RAB9A (0.46) HIF1APTGIRCREBBPPTGS2NPC1
SCHEMBL23400268 0.79 CREBBP (0.45) HIF1APTGIRCREBBPPTGS2NPC1
SCHEMBL13737154 0.79 NPC1 (0.59) CREBBPPTGS2NPC1RAB9AMAPT
SCHEMBL3562130 0.79 HTR2A (0.47) HIF1APTGIRCREBBPPDE2APRMT5
SCHEMBL5966750 0.79 CREBBP (0.45) HIF1APTGIRCREBBPPTGS2NPC1

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
EP-0299407-A1 1H-pyrazole-1-alkanamides and preparation useful as antiarrhythmic agents STERLING DRUG INC. (US) 1989-01-18 EP disclosed