SCHEMBL29769935

SCHEMBL29769935

CCOc1ccccc1NC(=O)N1CCN(Cc2ccc(C(=O)Nc3nc4ccccc4s3)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 5/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ KDM4E B2RXH2 2/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ HPGD P15428 1/20 0.53
▸ RXFP1 Q9HBX9 1/20 0.53
▸ SSTR5 P35346 2/20 0.51
▸ ADORA2A P29274 1/20 0.51
▸ ADORA1 P30542 1/20 0.51
▸ POLB P06746 1/20 0.51
▸ HCAR1 Q9BXC0 2/20 0.49
▸ HCAR2 Q8TDS4 1/20 0.49
▸ NPC1 O15118 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ SCD O00767 1/20 0.48
▸ NFKB1 P19838 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ NFKB2 Q00653 1/20 0.48
▸ RELA Q04206 1/20 0.48

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
SCHEMBL27193123 1.00 FAAH (0.53) FAAHMEN1KMT2AKDM4EHSD17B10
SCHEMBL29263370 0.90 KDM4E (0.56) MEN1KMT2AKDM4EHSD17B10HPGD
SCHEMBL26606537 0.88 ADORA2A (0.53) FAAHMEN1KMT2AKDM4EHSD17B10
SCHEMBL30576838 0.88 ADORA2A (0.53) FAAHMEN1KMT2AKDM4EHSD17B10
SCHEMBL26606488 0.85 ADORA2A (0.54) FAAHMEN1KMT2AKDM4EHSD17B10
SCHEMBL26606499 0.85 FAAH (0.60) FAAHMEN1KMT2AKDM4EHSD17B10
SCHEMBL29769922 0.85 ADORA2A (0.54) FAAHMEN1KMT2AKDM4EHSD17B10
SCHEMBL30576805 0.85 FAAH (0.60) FAAHMEN1KMT2AKDM4EHSD17B10
SCHEMBL30576793 0.84 ADORA2A (0.56) MEN1KMT2AKDM4EHSD17B10HPGD
SCHEMBL26606549 0.84 ADORA2A (0.56) MEN1KMT2AKDM4EHSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122079899-A Application of pharmaceutical composition in preparation of medicines for preventing or treating diseases related to Sirttail 7 protein — 2026-05-26 — — CN disclosed
EP-4269394-A1 BENZOTHIAZOLE AND BENZIMIDAZOLE DERIVATIVES, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT Korea Research Institute of Chemical Technology (KR) 2023-11-01 — — EP disclosed
CN-116829542-A Benzothiazole and benzimidazole derivatives, pharmaceutically acceptable salts, preparation method thereof and pharmaceutical composition containing same as active ingredient 韩国化学研究院 2023-09-29 — — CN disclosed
WO-2022164135-A1 BENZOTHIAZOLE AND BENZIMIDAZOLE DERIVATIVES, PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREFOR, AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT 한국화학연구원 2022-08-04 — — WO disclosed
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