SCHEMBL8042544

SCHEMBL8042544

CCC(=O)NC1CC2CCC1C2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.54
SIGMAR1 Q99720 3/20 0.54
ALDH1A1 P00352 2/20 0.54
EPHX1 P07099 1/20 0.53
TAS1R3 Q7RTX0 1/20 0.50
TAS1R1 Q7RTX1 1/20 0.50
TAS1R2 Q8TE23 1/20 0.50
MAPT P10636 1/20 0.49
PANK3 Q9H999 1/20 0.47
HPGD P15428 2/20 0.46
HSD17B10 Q99714 1/20 0.46
GRIN2D O15399 1/20 0.45
GRIN3B O60391 1/20 0.45
GRIN1 Q05586 1/20 0.45
GRIN2A Q12879 1/20 0.45
GRIN2B Q13224 1/20 0.45
GRIN2C Q14957 1/20 0.45
GRIN3A Q8TCU5 1/20 0.45
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL20215892 0.90 ALDH1A1 (0.44) EPHX2SIGMAR1ALDH1A1EPHX1TAS1R3
SCHEMBL16853213 0.88 TRPV1 (0.40) EPHX2SIGMAR1ALDH1A1EPHX1TAS1R3
SCHEMBL4863536 0.81 EPHX2 (0.59) EPHX2SIGMAR1ALDH1A1EPHX1TAS1R3
SCHEMBL5590888 0.80 EPHX2 (0.58) EPHX2SIGMAR1ALDH1A1EPHX1TAS1R3
SCHEMBL5590882 0.80 EPHX2 (0.58) EPHX2SIGMAR1ALDH1A1EPHX1TAS1R3
SCHEMBL5590880 0.80 EPHX2 (0.58) EPHX2SIGMAR1ALDH1A1EPHX1TAS1R3
SCHEMBL19688352 0.80 EPHX2 (0.58) EPHX2SIGMAR1ALDH1A1EPHX1TAS1R3
SCHEMBL3071717 0.79 EPHX2 (0.61) EPHX2SIGMAR1ALDH1A1EPHX1TAS1R3
SCHEMBL3068813 0.79 EPHX1 (0.76) EPHX2SIGMAR1ALDH1A1EPHX1TAS1R3
SCHEMBL3065279 0.79 EPHX2 (0.53) EPHX2SIGMAR1ALDH1A1EPHX1TAS1R3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0868420-B1 3-PYRAZOLECARBOXAMIDE DERIVATIVES HAVING CANNABINOID RECEPTOR AFFINITY SANOFI SYNTHELABO (FR) 2000-03-29 EP disclosed
EP-0885889-A2 Process for the preparation of pyrazole-3-carboxylic acids SANOFI (FR) 1998-12-23 EP disclosed
US-5624941-A Pyrazole derivatives, method of preparing them and pharmaceutical compositions in which they are present SANOFI (FR) 1997-04-29 US disclosed
EP-0576357-B1 Pyrazole derivatives, process for their preparation and pharmaceutical compositions containing them SANOFI SA (FR) 1997-03-05 EP disclosed
EP-0576357-A1 Pyrazole derivatives, process for their preparation and pharmaceutical compositions containing them SANOFI (FR) 1993-12-29 EP disclosed