SCHEMBL6965688

SCHEMBL6965688

[CH2]OC(=O)Cc1cc(C)on1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 1/20 0.40
GAA P10253 2/20 0.39
ALDH1A1 P00352 1/20 0.39
EGFR P00533 1/20 0.39
MAPT P10636 3/20 0.39
RECQL P46063 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
GAPDH P04406 1/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
KDM4E B2RXH2 1/20 0.38
CYP2C19 P33261 1/20 0.37
KLK7 P49862 1/20 0.36
BMP1 P13497 1/20 0.36
POLB P06746 1/20 0.36
CCNE1 P24864 1/20 0.36
CDK2 P24941 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
SCHEMBL2828069 0.84 KDM4E (0.44) EPHX2NPC1RAB9AGAAALDH1A1
SCHEMBL6961965 0.83 NPC1 (0.41) EPHX2NPC1RAB9AGAAALDH1A1
SCHEMBL18623686 0.83 NPC1 (0.50) NPC1RAB9AALDH1A1MAPTSMN1; SMN2
SCHEMBL724170 0.78 ALDH1A1 (0.43) EPHX2NPC1RAB9AGAAALDH1A1
SCHEMBL15719546 0.78 ALDH1A1 (0.43) EPHX2NPC1RAB9AGAAALDH1A1
SCHEMBL691738 0.77 HTT (0.44) EPHX2NPC1RAB9AGAAALDH1A1
SCHEMBL23716391 0.76 MAPT (0.40) EPHX2NPC1RAB9AGAAALDH1A1
SCHEMBL20020213 0.74 ALDH1A1 (0.47) EPHX2NPC1RAB9AGAAALDH1A1
SCHEMBL6964641 0.73 NOTUM (0.58) NPC1RAB9AGAAALDH1A1MAPT
SCHEMBL2824498 0.72 ALDH1A1 (0.46) EPHX2NPC1GAAALDH1A1EGFR

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