SCHEMBL11327540

SCHEMBL11327540

ClCc1nnc(C2CCCCC2)[nH]1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ APOBEC3G Q9HC16 1/20 0.37
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ GFER P55789 1/20 0.32
▸ ADORA2A P29274 3/20 0.31
▸ ADORA2B P29275 3/20 0.31
▸ ADORA1 P30542 1/20 0.31
▸ NISCH Q9Y2I1 1/20 0.31

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
SCHEMBL13572996 0.78 KDM4E (0.45) KDM4EALDH1A1HPGDHSD17B10APOBEC3G
SCHEMBL24317084 0.74 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10APOBEC3G
SCHEMBL13512799 0.71 KDM4E (0.39) KDM4EALDH1A1HPGDHSD17B10APOBEC3G
SCHEMBL17918659 0.71 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10APOBEC3G
SCHEMBL6970737 0.71 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10APOBEC3G
SCHEMBL12899384 0.68 ADORA1 (0.35) ADORA2AADORA1
SCHEMBL15934084 0.68 KDM4E (0.41) KDM4EALDH1A1HPGDHSD17B10APOBEC3G
SCHEMBL6958865 0.67 L3MBTL1 (0.37) KDM4EALDH1A1HPGDHSD17B10APOBEC3G
SCHEMBL6958862 0.67 KDM4E (0.36) KDM4EALDH1A1HPGDHSD17B10APOBEC3G
SCHEMBL2813510 0.67 — —

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-4267338-A INTERMEDIATES IN THE PRODUCTION OF N-AZOLYLALKYL-HALOGENOACETANILIDE HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1981-05-12 — — US disclosed
EP-0003539-B1 N-AZOLYLALKYL-HALOGENOACETANILIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS HERBICIDES BAYER AG (DE) 1981-04-08 — — EP disclosed
EP-0003540-B1 N-AZOLYLALKYL ANILINES AND PROCESS FOR THEIR PREPARATION BAYER AG (DE) 1980-10-01 — — EP disclosed
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