SCHEMBL30102517

SCHEMBL30102517

Cc1cccnc1C1(F)CCN(C(=O)Nc2ccc(N(C)C)cc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 11/20 0.58
▸ SMN1; SMN2 Q16637 2/20 0.51
▸ GAA P10253 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ TP53 P04637 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ ESR2 Q92731 1/20 0.51
▸ KIT P10721 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ NAMPT P43490 1/20 0.43
▸ CNR2 P34972 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ MAPK1 P28482 1/20 0.41

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
SCHEMBL2723517 1.00 TRPV1 (0.58) TRPV1SMN1; SMN2GAAMEN1TP53
SCHEMBL2724621 0.89 TRPV1 (0.62) TRPV1SMN1; SMN2KDM4EALDH1A1MAPT
SCHEMBL31679061 0.87 TRPV1 (0.66) TRPV1SMN1; SMN2GAAALDH1A1LMNA
SCHEMBL2725222 0.87 TRPV1 (0.66) TRPV1SMN1; SMN2GAAALDH1A1LMNA
SCHEMBL31679069 0.86 TRPV1 (0.59) TRPV1SMN1; SMN2GAAKDM4EALDH1A1
SCHEMBL2725244 0.86 TRPV1 (0.59) TRPV1SMN1; SMN2GAAKDM4EALDH1A1
SCHEMBL2724882 0.85 TRPV1 (0.58) TRPV1SMN1; SMN2KMT2AALDH1A1MAPT
SCHEMBL2723627 0.85 TRPV1 (0.61) TRPV1
SCHEMBL2724955 0.85 TRPV1 (0.58) TRPV1SMN1; SMN2GAAKDM4EALDH1A1
SCHEMBL2724894 0.85 TRPV1 (0.67) TRPV1

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
EP-3393462-B1 COMPOSITIONS AND METHODS FOR TREATMENT, AMELIORATION, AND PREVENTION OF ANESTHESIA-INDUCED HYPOTHERMIA UNIV ARIZONA (US) 2023-02-01 — — EP claimed
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