SCHEMBL9079656

SCHEMBL9079656

CCCCCCCCCCCCCCCc1cccc(OC(N)CC)c1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 8/20 0.57
PPARG P37231 5/20 0.57
LPL P06858 1/20 0.47
LIPG Q9Y5X9 1/20 0.47
CNR1 P21554 1/20 0.46
CNR2 P34972 1/20 0.46
S1PR4 O95977 1/20 0.45
S1PR1 P21453 1/20 0.45
S1PR3 Q99500 1/20 0.45
S1PR5 Q9H228 1/20 0.45

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
SCHEMBL4612597 0.90 PPARA (0.56) PPARAPPARGLPLLIPGCNR1
SCHEMBL10699535 0.84 PPARA (0.58) PPARAPPARGLPLLIPGCNR1
SCHEMBL11320810 0.84 PPARA (0.62) PPARAPPARGLPLLIPGCNR1
SCHEMBL9326238 0.81 TAAR1 (0.46)
SCHEMBL6667450 0.81 PPARA (0.59) PPARAPPARGLPLLIPGCNR1
SCHEMBL9436008 0.81 PPARA (0.59) PPARAPPARGLPLLIPGCNR1
SCHEMBL31442618 0.81 PPARA (0.58) PPARAPPARGLPLLIPGCNR1
SCHEMBL31442554 0.81 PPARA (0.58) PPARAPPARGLPLLIPGCNR1
SCHEMBL28916871 0.81 PPARA (0.58) PPARAPPARGLPLLIPGCNR1
SCHEMBL11630644 0.80 PPARA (0.54) PPARAPPARGCNR1CNR2

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-5556987-A Process for producing pyrazolecarboxamide derivative FUJI PHOTO FILM CO., LTD. (JP) 1996-09-17 US disclosed