SCHEMBL6969842

SCHEMBL6969842

[CH2]Oc1cccc2nnsc12

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.30
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL6969847 0.81 NQO2 (0.47) NPC1TP53MAPTRAB9ASMN1; SMN2
SCHEMBL7919531 0.77 MAPT (0.33) NPC1TP53MAPTRAB9ASMN1; SMN2
SCHEMBL7059454 0.74 MEN1 (0.38) NPC1TP53MAPTRAB9ASMN1; SMN2
SCHEMBL9363731 0.74 MAPT (0.32) MAPT
SCHEMBL8057087 0.74 MAPT (0.38) NPC1TP53MAPTRAB9ASMN1; SMN2
SCHEMBL9522187 0.72 KDM4E (0.44) NPC1TP53MAPTRAB9ASMN1; SMN2
SCHEMBL7603698 0.72 MAPT (0.39) NPC1TP53MAPTRAB9ASMN1; SMN2
SCHEMBL6964915 0.70 MAPT (0.35) NPC1TP53MAPTRAB9ASMN1; SMN2
SCHEMBL29561649 0.69
SCHEMBL8485908 0.69 PSMB8 (0.42) NPC1TP53MAPT

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-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed