SCHEMBL30925909

SCHEMBL30925909

CCCOc1cc(/C=N/NC(=O)c2cncc(-c3ccc(OCC)cc3)n2)cc(OC)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCN2A Q99250 4/20 0.52
▸ SCN10A Q9Y5Y9 4/20 0.52
▸ ALDH1A1 P00352 6/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ TP53 P04637 1/20 0.47
▸ HPGD P15428 5/20 0.45
▸ KDM4E B2RXH2 3/20 0.45
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ PAX8 Q06710 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ MGAM O43451 1/20 0.44
▸ MAPT P10636 4/20 0.44
▸ THRB P10828 1/20 0.44
▸ MAPK1 P28482 1/20 0.43
▸ HTT P42858 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ LMNA P02545 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42

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
SCHEMBL29214943 1.00 SCN2A (0.52) SCN2ASCN10AALDH1A1RAB9ATP53
SCHEMBL24994370 1.00 SCN2A (0.52) SCN2ASCN10AALDH1A1RAB9ATP53
SCHEMBL29215006 0.96 SCN2A (0.51) SCN2ASCN10AALDH1A1RAB9ATP53
SCHEMBL24993395 0.96 SCN2A (0.51) SCN2ASCN10AALDH1A1RAB9ATP53
SCHEMBL29215160 0.95 SCN2A (0.48) SCN2ASCN10AALDH1A1RAB9ATP53
SCHEMBL24993617 0.95 SCN2A (0.48) SCN2ASCN10AALDH1A1RAB9ATP53
SCHEMBL30925931 0.95 SCN2A (0.57) SCN2ASCN10AALDH1A1RAB9ATP53
SCHEMBL29215186 0.95 SCN2A (0.57) SCN2ASCN10AALDH1A1RAB9ATP53
SCHEMBL29215180 0.95 SCN2A (0.57) SCN2ASCN10AALDH1A1RAB9ATP53
SCHEMBL24994774 0.93 SCN2A (0.51) SCN2ASCN10AALDH1A1RAB9ATP53

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
CN-118076348-A N-acylhydrazone compounds capable of inhibiting NAV 1.7 and/or NAV 1.8, methods of making, compositions, uses, methods of treatment and kits using the same 欧罗法玛实验室股份公司 2024-05-24 — — CN claimed
CN-118076348-A N-acylhydrazone compounds capable of inhibiting NAV 1.7 and/or NAV 1.8, methods of making, compositions, uses, methods of treatment and kits using the same 欧罗法玛实验室股份公司 2024-05-24 — — CN disclosed
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