SCHEMBL7931403

SCHEMBL7931403

CCCCCCCCCCCCCCCOCC(O)c1cccc2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.44
CNR2 P34972 2/20 0.44
PPARG P37231 4/20 0.43
PPARA Q07869 2/20 0.43
USP2 O75604 1/20 0.43
CYP2C9 P11712 1/20 0.42
HTT P42858 1/20 0.42
KDM4E B2RXH2 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SPHK1 Q9NYA1 1/20 0.39
TSHR P16473 1/20 0.39
PLA2G2D Q9UNK4 1/20 0.39

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
SCHEMBL8377469 0.88 PPARG (0.47) CNR1CNR2PPARGPPARACYP2C9
SCHEMBL3905545 0.82 PPARG (0.48) PPARGPPARACYP2C9KDM4EKMT2A
SCHEMBL10901230 0.82 PPARG (0.48) PPARGPPARACYP2C9KDM4EKMT2A
SCHEMBL28732572 0.82 PPARG (0.48) PPARGPPARACYP2C9KDM4EKMT2A
SCHEMBL8377476 0.82 PPARG (0.48) PPARGPPARACYP2C9KDM4EKMT2A
SCHEMBL11339313 0.82 PPARG (0.48) PPARGPPARACYP2C9KDM4EKMT2A
SCHEMBL11724981 0.82 PPARG (0.48) PPARGPPARACYP2C9KDM4EKMT2A
SCHEMBL9770334 0.82 CYP2C19 (0.48) CYP2C9HTTKDM4EKMT2ATSHR
SCHEMBL8481171 0.81 KMT2A (0.43) CYP2C9HTTKDM4EKMT2ATSHR
Ammonia Solution, Strong SCHEMBL29170081 0.81 PPARG (0.47) PPARGPPARACYP2C9KDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6297207-B1 METAL AND NONMETAL COMPLEXES OF PHTHALOCYANINE TYPE COMPOUNDS CASE WESTERN RESERVE UNIVERSITY 2001-10-02 US disclosed
EP-0960183-A2 PHOTOCHEMICAL SINGLET OXYGEN GENERATORS HAVING ENHANCED SINGLET OXYGEN YIELDS THE PROCTER & GAMBLE COMPANY (US) 1999-12-01 EP disclosed
WO-1998032825-A2 PHOTOCHEMICAL SINGLET OXYGEN GENERATORS HAVING ENHANCED SINGLET OXYGEN YIELDS THE PROCTER & GAMBLE COMPANY (US) 1998-07-30 WO disclosed