SCHEMBL28943277

SCHEMBL28943277

O=C(Nc1cccc(Cl)c1)N1CCCC1c1ncc(-c2ccccc2)s1

nearest known ligand 0.77

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 6/20 0.77
▸ TRPM8 Q7Z2W7 1/20 0.77
▸ ALDH1A1 P00352 3/20 0.52
▸ HPGD P15428 1/20 0.52
▸ TSHR P16473 1/20 0.52
▸ POLB P06746 2/20 0.51
▸ AADAT Q8N5Z0 1/20 0.49
▸ CPT1A P50416 1/20 0.47
▸ DGAT1 O75907 1/20 0.47
▸ MEN1 O00255 1/20 0.46
▸ RECQL P46063 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ ADAM17 P78536 1/20 0.46
▸ MAPT P10636 2/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ TP53 P04637 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
SCHEMBL28943276 1.00 TRPV1 (0.77) TRPV1TRPM8ALDH1A1HPGDTSHR
SCHEMBL30212118 1.00 TRPV1 (0.77) TRPV1TRPM8ALDH1A1HPGDTSHR
SCHEMBL28943335 0.86 TRPV1 (0.66) TRPV1TRPM8POLBAADATCPT1A
SCHEMBL28943334 0.86 TRPV1 (0.66) TRPV1TRPM8POLBAADATCPT1A
SCHEMBL28943343 0.84 TRPV1 (0.72) TRPV1TRPM8POLBAADATCPT1A
SCHEMBL28943340 0.84 TRPV1 (0.72) TRPV1TRPM8POLBAADATCPT1A
SCHEMBL28963951 0.83 TRPV1 (0.72) TRPV1TRPM8ALDH1A1TSHRPOLB
SCHEMBL28963950 0.83 TRPV1 (0.72) TRPV1TRPM8ALDH1A1TSHRPOLB
SCHEMBL30212113 0.83 TRPV1 (0.72) TRPV1TRPM8ALDH1A1TSHRPOLB
SCHEMBL28943292 0.82 TRPV1 (0.70) TRPV1TRPM8ALDH1A1POLBAADAT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111423432-B (S) -4/5-phenyl-2- (pyrrolidine-2-yl) thiazole TRPV1 antagonist and preparation and application thereof 河南大学 2023-01-24 — — CN claimed
CN-111423432-A (S) -4/5-phenyl-2- (pyrrolidine-2-yl) thiazole TRPV1 antagonist and preparation and application thereof 河南大学 2020-07-17 — — CN claimed
CN-111423432-B (S) -4/5-phenyl-2- (pyrrolidine-2-yl) thiazole TRPV1 antagonist and preparation and application thereof 河南大学 2023-01-24 — — CN disclosed
CN-111423432-A (S) -4/5-phenyl-2- (pyrrolidine-2-yl) thiazole TRPV1 antagonist and preparation and application thereof 河南大学 2020-07-17 — — CN disclosed
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