SCHEMBL8664520

SCHEMBL8664520

CCc1ccc(C(O)CON2C(=O)SC(Cc3ccccc3)C2=O)nc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.56
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
CYP3A4 P08684 2/20 0.37
RXRA P19793 1/20 0.37
CYP2C9 P11712 2/20 0.37
MPC2 O95563 1/20 0.37
CYP2C8 P10632 1/20 0.37
GRIN2B Q13224 3/20 0.36
MCL1 Q07820 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 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
SCHEMBL24599231 0.80 PPARG (0.72) PPARGCYP3A4RXRACYP2C9MPC2
SCHEMBL8660907 0.80 PPARG (0.53) PPARGKDM4EMAPTCYP3A4RXRA
SCHEMBL19217761 0.79 PPARG (0.68) PPARGCYP3A4RXRACYP2C9MPC2
SCHEMBL6032172 0.75 MAPT (0.53) PPARGKDM4EMAPTCYP3A4CYP2C9
SCHEMBL6928369 0.71 PPARG (1.00) PPARGMAPTCYP3A4RXRACYP2C9
SCHEMBL6929811 0.71 PPARG (1.00) PPARGMAPTCYP3A4RXRACYP2C9
SCHEMBL2328760 0.71 PPARG (1.00) PPARGMAPTCYP3A4RXRACYP2C9
SCHEMBL2328758 0.71 PPARG (1.00) PPARGMAPTCYP3A4RXRACYP2C9
SCHEMBL23836844 0.71 PPARG (1.00) PPARGMAPTCYP3A4RXRACYP2C9
SCHEMBL18541508 0.71 PPARG (1.00) PPARGMAPTCYP3A4RXRACYP2C9

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
US-5824694-A Thiazolidine derivatives for the treatment of psoriasis BETHESDA PHARMACEUTICALS, INC. (US) 1998-10-20 US disclosed