SCHEMBL8324311

SCHEMBL8324311

Fc1ccc(-c2[nH]c3ncc(F)cc3c2-c2ccncc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 17/20 0.69
MAPK13 O15264 10/20 0.69
MAPK12 P53778 10/20 0.69
MAPK11 Q15759 10/20 0.69
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
SLC6A2 P23975 1/20 0.48
HTR2C P28335 1/20 0.48
ADORA2A P29274 1/20 0.48
ADORA1 P30542 1/20 0.48
KIT P10721 1/20 0.47

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
SCHEMBL27546673 0.82 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6250930 0.82 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6640822 0.77 MAPK14 (0.69) MAPK14MAPK13MAPK12MAPK11CYP3A4
SCHEMBL18951978 0.77 MAPK14 (0.43) MAPK14MAPK13MAPK12MAPK11KIT
SCHEMBL6641332 0.76 MAPK14 (0.67) MAPK14MAPK13MAPK12MAPK11CYP3A4
SCHEMBL6643267 0.76 MAPK14 (0.66) MAPK14MAPK13MAPK12MAPK11CYP3A4
SCHEMBL6643643 0.75 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11
SCHEMBL6640941 0.75 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11CYP3A4
SCHEMBL1994242 0.75 MAPK14 (1.00) MAPK14MAPK13MAPK12MAPK11CYP3A4
SCHEMBL6645674 0.75 MAPK14 (0.51) MAPK14MAPK13MAPK12MAPK11

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-0948495-A1 ARYL AND HETEROARYL SUBSTITUTED FUSED PYRROLE ANTIINFLAMMATORY AGENTS Amgen Inc., (US) 1999-10-13 EP claimed
WO-1998022457-A1 ARYL AND HETEROARYL SUBSTITUTED FUSED PYRROLE ANTIINFLAMMATORY AGENTS AMGEN INC. (US) 1998-05-28 WO claimed