SCHEMBL6664765

SCHEMBL6664765

C=CC(=O)N(C)Cc1cccs1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 1/20 0.56
▸ ALDH1A1 P00352 2/20 0.53
▸ HTT P42858 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ HSD11B1 P28845 8/20 0.52
▸ CYP3A4 P08684 3/20 0.51
▸ TRPM8 Q7Z2W7 2/20 0.50
▸ POLB P06746 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50
▸ CYP2C9 P11712 1/20 0.50
▸ RAB9A P51151 2/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ NPC1 O15118 1/20 0.48
▸ LIPE Q05469 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ HPGD P15428 1/20 0.45

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
SCHEMBL28956568 0.85 POLB (0.58) RIPK1ALDH1A1HTTTRPM8POLB
SCHEMBL28195194 0.81 TRPM8 (0.62) TRPM8POLBTDP1
SCHEMBL21400322 0.80 RIPK1 (0.62) RIPK1ALDH1A1HTTL3MBTL1HSD11B1
SCHEMBL6122487 0.78 RIPK1 (0.60) RIPK1ALDH1A1HTTL3MBTL1HSD11B1
SCHEMBL27677131 0.77 RIPK1 (0.56) RIPK1ALDH1A1HTTL3MBTL1HSD11B1
SCHEMBL12313812 0.77 RIPK1 (0.63) RIPK1ALDH1A1HSD11B1CYP3A4TRPM8
SCHEMBL9668325 0.75 RIPK1 (0.57) RIPK1ALDH1A1HTTHSD11B1CYP3A4
SCHEMBL3323893 0.75 RIPK1 (0.75) RIPK1ALDH1A1HSD11B1CYP3A4TRPM8
SCHEMBL13870657 0.75 RIPK1 (0.57) RIPK1ALDH1A1HTTHSD11B1CYP3A4
SCHEMBL19472466 0.73 EGFR (0.50) RIPK1ALDH1A1HTTPOLBRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101001912-B Nanosubstance-containing composition, method for producing same, and composite using same MITSUBISHI RAYON CO 2010-11-17 — — CN disclosed
CN-101001912-A Nanosubstance-containing composition, method for producing same, and composite using same MITSUBISHI RAYON CO (JP) 2007-07-18 — — CN disclosed
EP-1226138-B1 FAB I INHIBITORS AFFINIUM PHARM INC (CA) 2004-12-29 — — EP disclosed
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