SCHEMBL10602010

SCHEMBL10602010

C=CCc1oc2ccccc2c1C(=O)c1ccccc1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 7/20 0.46
MAPT P10636 3/20 0.44
THRB P10828 2/20 0.44
EYA3 Q99504 4/20 0.43
SLC22A12 Q96S37 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
TSHR P16473 2/20 0.43
HSD17B10 Q99714 2/20 0.43
KDM4E B2RXH2 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
BCHE P06276 1/20 0.42
CYP2C9 P11712 4/20 0.41
KDM7A Q6ZMT4 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
ABCB11 O95342 2/20 0.41
LMNA P02545 2/20 0.41
TTR P02766 2/20 0.41
PGR P06401 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
SCHEMBL9444850 0.85 CYP2C19 (0.62) CYP2C19MAPTTHRBEYA3SLC22A12
SCHEMBL10599107 0.82 CYP2C19 (0.63) CYP2C19MAPTEYA3SLC22A12ALDH1A1
SCHEMBL11849369 0.81 EYA3 (0.63) THRBEYA3KDM7ATTRPTPN1
SCHEMBL9267705 0.79 EYA3 (0.55) CYP2C19MAPTTHRBEYA3SLC22A12
SCHEMBL4430343 0.78 EYA3 (0.44) CYP2C19MAPTTHRBEYA3SLC22A12
SCHEMBL2141567 0.76 EYA3 (0.69) CYP2C19MAPTTHRBEYA3SLC22A12
SCHEMBL10598815 0.75 EYA3 (0.54) CYP2C19EYA3SLC22A12CYP2C9KDM7A
SCHEMBL9605230 0.75 EYA3 (0.43) CYP2C19MAPTTHRBEYA3SLC22A12
SCHEMBL9287304 0.72 EYA3 (0.53) CYP2C19MAPTTHRBEYA3SLC22A12
SCHEMBL9444777 0.71 EYA3 (0.55) CYP2C19MAPTTHRBEYA3SLC22A12

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-0210156-B1 MOLECULAR COMPLEXES FORMED FROM A BENZOFURANE DERIVATIVE AND ALUMINIUM CHLORIDE, THEIR PREPARATION AND THEIR USE SANOFI (FR) 1989-01-25 EP claimed