SCHEMBL11442250

SCHEMBL11442250

C=CC(=O)N(c1ccccc1)C1CC(Br)CC1O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TRPM8 Q7Z2W7 2/20 0.35
▸ PTGDR2 Q9Y5Y4 4/20 0.32
▸ MEN1 O00255 3/20 0.31
▸ KMT2A Q03164 3/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ MITF O75030 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ PAX8 Q06710 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ AKT1 P31749 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ NPY2R P49146 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
SCHEMBL11437818 0.78 OPRM1 (0.45) —
SCHEMBL11437893 0.78 OPRM1 (0.45) —
SCHEMBL11579712 0.70 TRPM8 (0.44) TRPM8MEN1KMT2AALDH1A1KDM4E
SCHEMBL11500743 0.69 TRPM8 (0.46) TRPM8MEN1KMT2AALDH1A1KDM4E
SCHEMBL18763039 0.69 TRPM8 (0.67) TRPM8MEN1KMT2AALDH1A1KDM4E
SCHEMBL9905800 0.69 CHRM1 (0.59) —
SCHEMBL11442252 0.67 CHRM2 (0.36) TRPM8MEN1KMT2ALMNA
SCHEMBL17980354 0.65 LMNA (0.39) TRPM8PTGDR2MEN1KMT2ASMN1; SMN2
SCHEMBL28162843 0.65 AKT1 (0.48) TRPM8MEN1KMT2AALDH1A1NPC1
SCHEMBL11808638 0.65 AKT1 (0.43) TRPM8KMT2AALDH1A1KDM4ENPC1

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
US-4217362-A Anilide derivatives as antidepressants THE UPJOHN COMPANY (US) 1980-08-12 — — US disclosed
US-4212888-A Anilide derivatives as antidepressants THE UPJOHN COMPANY (US) 1980-07-15 — — US disclosed
US-4128663-A Anilide derivatives as antidepressants THE UPJOHN COMPANY (US) 1978-12-05 — — US disclosed
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