SCHEMBL6969357

SCHEMBL6969357

[CH2]OC(=O)Cc1cc(C)oc1C

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.46
MAPT P10636 5/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 5/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
RAB9A P51151 1/20 0.36
RECQL P46063 1/20 0.35
APEX1 P27695 2/20 0.34
HPGD P15428 1/20 0.33
POLB P06746 1/20 0.33
MEN1 O00255 1/20 0.33
HTT P42858 1/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
MAPK10 P53779 1/20 0.32

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
SCHEMBL6969363 0.84 ALOX5 (0.47) ALOX5MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL6965763 0.80 L3MBTL1 (0.45) MAPTKDM4EALDH1A1SMN1; SMN2RAB9A
SCHEMBL6957884 0.80 PTGER4 (0.33) ALOX5MAPTALDH1A1SMN1; SMN2POLB
SCHEMBL17468787 0.77 ALOX5 (0.51) ALOX5MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL9566160 0.76 ALOX5 (0.50) ALOX5MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL9566169 0.69 ALOX5 (0.43) ALOX5MAPTKDM4EALDH1A1RAB9A
SCHEMBL3031292 0.69
SCHEMBL3100001 0.68
SCHEMBL13992152 0.67 NPSR1 (0.57) ALOX5MAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL6965688 0.67 EPHX2 (0.40) MAPTKDM4EALDH1A1SMN1; SMN2RAB9A

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