SCHEMBL9525533

SCHEMBL9525533

CCCN(C)c1ccc(C(=O)Nc2c(C)cccc2C)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 8/20 0.54
▸ MAPT P10636 4/20 0.51
▸ ALDH1A1 P00352 3/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ HPGD P15428 1/20 0.51
▸ ALOX15 P16050 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ S1PR4 O95977 1/20 0.47
▸ CA12 O43570 1/20 0.46
▸ CA9 Q16790 1/20 0.46
▸ LMNA P02545 3/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ MC4R P32245 1/20 0.44
▸ SCN4A P35499 1/20 0.44
▸ MC3R P41968 1/20 0.44
▸ HTR3A P46098 1/20 0.44
▸ SCN5A Q14524 1/20 0.44
▸ SCN9A Q15858 1/20 0.44
▸ SCN3A Q9NY46 1/20 0.44

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
SCHEMBL9522516 0.82 KCNK3 (0.59) MAPTALDH1A1KDM4EHPGDALOX15
SCHEMBL8000882 0.80 TRPV1 (0.66) TRPV1MAPTALDH1A1KDM4EHSD17B10
SCHEMBL14095548 0.77 HDAC6 (0.57) TRPV1
SCHEMBL2307872 0.76 S1PR4 (0.56) MAPTALDH1A1KDM4EHPGDALOX15
SCHEMBL9523014 0.75 S1PR4 (0.69) TRPV1MAPTALDH1A1KDM4EHPGD
SCHEMBL12652061 0.74 MAPT (0.59) MAPTALDH1A1HPGDHSD17B10LMNA
SCHEMBL9522743 0.74 S1PR4 (0.58) MAPTALDH1A1KDM4EHPGDS1PR4
SCHEMBL9522611 0.74 S1PR4 (0.51) MAPTALDH1A1KDM4EHPGDALOX15
SCHEMBL4138460 0.73 POLB (0.67) MAPTKDM4EHPGDS1PR4LMNA
SCHEMBL10357153 0.72 POLB (0.63) MAPTALDH1A1HPGDS1PR4LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0279633-B1 ANTICONVULSANT AGENTS ELI LILLY AND COMPANY (US) 1993-04-07 — — EP disclosed
US-4981866-A BENZAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 1991-01-01 — — US disclosed
US-4939163-A 4-substituted benzamide derivatives ELI LILLY AND COMPANY (US) 1990-07-03 — — US disclosed
US-4835181-A Anticonvulsant agents using cyano dimethylphenyl benzamides ELI LILLY AND COMPANY (US) 1989-05-30 — — US disclosed
EP-0279633-A2 Anticonvulsant agents ELI LILLY AND COMPANY (US) 1988-08-24 — — EP disclosed
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