SCHEMBL18965916

SCHEMBL18965916

CCC(C)(CC)Nc1ccc(-c2ccc(NC(=O)c3cc(C(c4ccc(C(=O)O)c(C(=O)C(C)(CC)CC)c4)(C(F)(F)F)C(F)(F)F)ccc3C(=O)O)cc2C(F)(F)F)c(C(F)(F)F)c1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SORT1 Q99523 7/20 0.39
▸ S1PR1 P21453 10/20 0.37
▸ S1PR3 Q99500 4/20 0.37
▸ CHRM2 P08172 1/20 0.35
▸ CHRM4 P08173 1/20 0.35
▸ CHRM5 P08912 1/20 0.35
▸ CHRM1 P11229 1/20 0.35
▸ CHRM3 P20309 1/20 0.35
▸ RORC P51449 1/20 0.34
▸ TMPRSS4 Q9NRS4 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
SCHEMBL18965923 0.93 SORT1 (0.39) SORT1S1PR1S1PR3CHRM2CHRM4
SCHEMBL18965936 0.90 S1PR1 (0.42) SORT1S1PR1S1PR3RORCTMPRSS4
SCHEMBL19850273 0.90 SORT1 (0.38) SORT1S1PR1S1PR3CHRM2CHRM4
SCHEMBL18965921 0.84 SORT1 (0.34) SORT1S1PR1S1PR3CHRM2CHRM4
SCHEMBL18965918 0.82 S1PR1 (0.42) SORT1S1PR1S1PR3RORCTMPRSS4
SCHEMBL19850348 0.80 S1PR1 (0.38) S1PR1S1PR3RORCTMPRSS4
SCHEMBL19850393 0.80 PTGS1 (0.42) SORT1S1PR1S1PR3RORCTMPRSS4
SCHEMBL19850364 0.78 S1PR1 (0.37) S1PR1S1PR3RORC
SCHEMBL10024745 0.77 SORT1 (0.44) SORT1S1PR1S1PR3TMPRSS4
SCHEMBL20025794 0.77 S1PR1 (0.41) SORT1S1PR1S1PR3TMPRSS4

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
US-20180093461-A1 RESIN COMPOSITION, POLYIMIDE RESIN FILM, AND METHOD FOR PRODUCING SAME ASAHI KASEI KABUSHIKI KAISHA (JP) 2018-04-05 — — US disclosed
US-20170165879-A1 RESIN PRECURSOR, RESIN COMPOSITION CONTAINING SAME, POLYIMIDE RESIN MEMBRANE, RESIN FILM, AND METHOD FOR PRODUCING SAME ASAHI KASEI KABUSHIKI KAISHA (JP) 2017-06-15 — — US disclosed
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