SCHEMBL8470258

SCHEMBL8470258

CC1CCC(C(C)C)C(N(c2ccc(N=O)cc2)C2CC(C)CCC2C(C)C)C1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 1/20 0.38
ALDH1A1 P00352 3/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
HIF1A Q16665 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TRPM8 Q7Z2W7 4/20 0.36
TRPA1 O75762 2/20 0.36
TRPV1 Q8NER1 5/20 0.35
LMNA P02545 1/20 0.35
EPHX1 P07099 1/20 0.35
HPGD P15428 1/20 0.33
CYP19A1 P11511 2/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33

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
SCHEMBL10363049 0.84 KCNA5 (0.42) KCNA5ALDH1A1TSHRMAPK1HSD17B10
SCHEMBL10363050 0.84 KCNA5 (0.42) KCNA5ALDH1A1TSHRMAPK1HSD17B10
SCHEMBL2481928 0.82 TRPM8 (0.40) KCNA5ALDH1A1TRPM8TRPA1TRPV1
SCHEMBL1903958 0.82 KCNA5 (0.39) KCNA5ALDH1A1TRPM8TRPA1TRPV1
SCHEMBL5182007 0.81 TRPM8 (0.39) KCNA5ALDH1A1TP53MAPK1TRPM8
SCHEMBL6235069 0.81 TRPM8 (0.39) KCNA5ALDH1A1TRPM8TRPA1TRPV1
SCHEMBL10949151 0.81 KCNA5 (0.49) KCNA5ALDH1A1TRPM8TRPA1TRPV1
SCHEMBL31752406 0.80 TRPM8 (0.46) KCNA5ALDH1A1TRPM8TRPA1TRPV1
SCHEMBL589762 0.78 CYP19A1 (0.45) KCNA5ALDH1A1TRPM8TRPA1TRPV1
SCHEMBL10364041 0.78 NPC1 (0.48) KCNA5ALDH1A1TSHRMAPK1HSD17B10

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
JP-11322698-A None JP disclosed
JP-H11322698-A AZAMETHINE AND ITS PRODUCTION SIEMENS AG 1999-11-24 JP disclosed