SCHEMBL28246584

SCHEMBL28246584

CCOC(=O)c1sc(-c2ccc(CN)cc2)nc1NC(=O)Nc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 5/20 0.60
▸ MAPT P10636 6/20 0.54
▸ MEN1 O00255 4/20 0.54
▸ KMT2A Q03164 4/20 0.54
▸ ALDH1A1 P00352 4/20 0.54
▸ HPGD P15428 2/20 0.54
▸ LMNA P02545 1/20 0.54
▸ PLA2G1B P04054 1/20 0.54
▸ HTT P42858 1/20 0.54
▸ ATG4B Q9Y4P1 1/20 0.54
▸ CDC7 O00311 5/20 0.54
▸ DBF4 Q9UBU7 5/20 0.54
▸ RAB9A P51151 4/20 0.52
▸ NPC1 O15118 3/20 0.52
▸ NFKB1 P19838 2/20 0.52
▸ NFKB2 Q00653 2/20 0.52
▸ RELA Q04206 2/20 0.52
▸ USP2 O75604 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52

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
SCHEMBL15049266 0.91 TRPM8 (0.64) TRPM8MAPTMEN1KMT2AALDH1A1
SCHEMBL28246574 0.86 RAB9A (0.46) TRPM8MAPTMEN1KMT2AALDH1A1
SCHEMBL28245895 0.85 TRPM8 (0.58) TRPM8MAPTMEN1KMT2AALDH1A1
SCHEMBL28245823 0.80 CDC7 (0.57) TRPM8MAPTMEN1KMT2ACDC7
SCHEMBL28245821 0.78 CDC7 (0.57) TRPM8MAPTMEN1KMT2ACDC7
SCHEMBL28246577 0.77 MEN1 (0.61) TRPM8MAPTMEN1KMT2AALDH1A1
SCHEMBL27997093 0.77 CDC7 (0.74) TRPM8MAPTMEN1KMT2ALMNA
SCHEMBL27997098 0.77 TRPM8 (0.78) TRPM8MAPTMEN1KMT2ACDC7
SCHEMBL15049068 0.74 TRPM8 (0.67) TRPM8MAPTMEN1KMT2AALDH1A1
SCHEMBL4920930 0.72 SMN1; SMN2 (0.78) MAPTMEN1KMT2AALDH1A1HPGD

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
CN-104220069-B Trpm8 antagonists 多姆皮制药公司 2018-10-02 — — CN disclosed
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