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Sugi Predict / Compounds / SCHEMBL2830157

SCHEMBL2830157

SCHEMBL2830157

CCCCN(C(=O)c1ccc(Cl)cc1)C(CC)c1ccc(F)c([Ti](C2=CC=CC2)(C2=CC=CC2)c2c(F)ccc(C(CC)N(CCCC)C(=O)c3ccc(Cl)cc3)c2F)c1F

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 13/20 0.36
▸ S1PR1 P21453 2/20 0.32
▸ TRPM8 Q7Z2W7 1/20 0.30

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
SCHEMBL482957 0.81 S1PR1 (0.39) S1PR1
SCHEMBL28600368 0.81 S1PR1 (0.39) S1PR1
SCHEMBL2830162 0.79 EGFR (0.40) S1PR1
SCHEMBL482967 0.79 S1PR1 (0.40) S1PR1
SCHEMBL599113 0.74 S1PR1 (0.35) S1PR1
SCHEMBL482889 0.73 HTR2C (0.37) —
SCHEMBL482918 0.73 MLYCD (0.37) S1PR1
SCHEMBL599447 0.72 S1PR1 (0.33) S1PR1
SCHEMBL4580105 0.71 S1PR1 (0.34) S1PR1
SCHEMBL29104873 0.71 — —

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-7741005-B2 A planographic printing plate precursor comprising: an aluminum support; and a photosensitive layer including a polymerization initiator, a polymerizable compound and a binder polymer; an oxygen barrier layer; and a protective layer including a filler; capable of image formation FUJIFILM CORPORATION (JP) 2010-06-22 — — US disclosed
US-20070231740-A1 A planographic printing plate precursor comprising: an aluminum support; and a photosensitive layer including a polymerization initiator, a polymerizable compound and a binder polymer; an oxygen barrier layer; and a protective layer including a filler; capable of image formation FUJIFILM CORPORATION (JP) 2007-10-04 — — US disclosed