SCHEMBL19519963

SCHEMBL19519963

Cc1cccc(CCC(=O)Cl)c1F

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ IAPP P10997 3/20 0.38
▸ PTGER4 P35408 2/20 0.36
▸ PTGER3 P43115 2/20 0.36
▸ PTGER2 P43116 2/20 0.36
▸ PTGER1 P34995 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ FFAR1 O14842 3/20 0.35
▸ FFAR4 Q5NUL3 3/20 0.35
▸ MPO P05164 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ CYP4F2 P78329 1/20 0.35
▸ CYP4A11 Q02928 1/20 0.35
▸ NOTUM Q6P988 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34

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
SCHEMBL30873963 0.84 NPSR1 (0.53) PTGER4PTGER3PTGER2PTGER1FFAR1
SCHEMBL1030914 0.84 NPSR1 (0.53) PTGER4PTGER3PTGER2PTGER1FFAR1
SCHEMBL4322411 0.82 CES2 (0.42) IAPPALDH1A1FFAR4MPOKDM4E
SCHEMBL4601007 0.82 TAAR1 (0.50) ALDH1A1NPSR1CYP4F2CYP4A11NOTUM
SCHEMBL12955273 0.80 CYP4F2 (0.43) ALDH1A1CYP4F2CYP4A11KDM4EHSD17B10
SCHEMBL17605475 0.79 IAPP (0.34) IAPPPTGER4PTGER3PTGER2PTGER1
SCHEMBL14128655 0.78 PTGER1 (0.47) PTGER4PTGER3PTGER2PTGER1FFAR1
SCHEMBL16958402 0.76 TAAR1 (0.38) ALDH1A1MPOHPGDHSD17B10
SCHEMBL2527059 0.74 TAAR1 (0.52) ALDH1A1FFAR1FFAR4MPOMEN1
SCHEMBL30799043 0.74 TAAR1 (0.52) ALDH1A1FFAR1FFAR4MPOMEN1

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
WO-2017184549-A1 PYRROLOPYRIDINE RETINOIC ACID RECEPTOR-RELATED ORPHAN RECEPTOR MODULATORS AND USES THEREOF INNOV17 LLC (US) 2017-10-26 — — WO disclosed
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