SCHEMBL10694327

SCHEMBL10694327

O=C(O)C[C@@H]1c2ccccc2O[C@H]1c1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RET P07949 1/20 0.47
KDR P35968 1/20 0.47
FFAR1 O14842 4/20 0.38
POLB P06746 1/20 0.38
HCRTR2 O43614 1/20 0.37
MDM2 Q00987 4/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
CFTR P13569 1/20 0.36
PTGDR2 Q9Y5Y4 1/20 0.36
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
ABCB1 P08183 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
SCHEMBL10689265 1.00 RET (0.47) RETKDRFFAR1POLBHCRTR2
SCHEMBL10694320 1.00 RET (0.47) RETKDRFFAR1POLBHCRTR2
SCHEMBL10655141 0.89 ABCB1 (0.39) FFAR1ESR1ESR2ABCB1
SCHEMBL10655166 0.89 ABCB1 (0.39) FFAR1ESR1ESR2ABCB1
SCHEMBL10655154 0.89 ABCB1 (0.39) FFAR1ESR1ESR2ABCB1
SCHEMBL10695009 0.89 ABCB1 (0.39) FFAR1ESR1ESR2ABCB1
SCHEMBL10656603 0.89 ABCB1 (0.39) FFAR1ESR1ESR2ABCB1
SCHEMBL10694322 0.82 EDNRA (0.49) POLBMEN1KMT2A
SCHEMBL10694325 0.82 EDNRA (0.49) POLBMEN1KMT2A
SCHEMBL10694317 0.82 EDNRA (0.49) POLBMEN1KMT2A

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-0264234-A1 Novel benzofurans and a novel method of preparation EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1988-04-20 EP disclosed