SCHEMBL9345650

SCHEMBL9345650

COc1ccc(OCC(C)Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
CYP2C9 P11712 2/20 0.45
TSHR P16473 1/20 0.45
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MTNR1A P48039 1/20 0.44
MTNR1B P49286 1/20 0.44
HPGD P15428 2/20 0.43
SCN4A P35499 2/20 0.42
SIGMAR1 Q99720 6/20 0.42
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
CYP2C19 P33261 1/20 0.42

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
SCHEMBL418159 0.91 CYP2C9 (0.52) MAPTCYP2C9TSHRALDH1A1MEN1
SCHEMBL8672225 0.86 DRD2 (0.49) MAPTPPARGPPARATSHRL3MBTL1
SCHEMBL9348566 0.84 NQO1 (0.50) MAPTCYP2C9TSHRALDH1A1MTNR1A
SCHEMBL9343776 0.84 NQO1 (0.50) MAPTCYP2C9TSHRALDH1A1MTNR1A
SCHEMBL8436935 0.84 LMNA (0.52) MAPTCYP2C9TSHRKMT2AMTNR1A
SCHEMBL9344357 0.84 NQO1 (0.50) MAPTCYP2C9TSHRALDH1A1MTNR1A
SCHEMBL8436949 0.84 LMNA (0.52) MAPTCYP2C9TSHRKMT2AMTNR1A
SCHEMBL9343769 0.81 ALDH1A1 (0.48) MAPTCYP2C9TSHRALDH1A1MEN1
SCHEMBL6843190 0.81 APP (0.49) MAPTCYP2C9TSHRALDH1A1MEN1
SCHEMBL9348248 0.80 CYP1A1 (0.49) MAPTCYP2C9TSHRALDH1A1MEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0357409-B1 Heat-sensitive recording material FUJI PHOTO FILM CO LTD (JP) 1994-07-20 EP disclosed
EP-0357409-A2 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. (JP) 1990-03-07 EP disclosed