SCHEMBL8816

SCHEMBL8816

O=[C]OCc1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.52
AGXT P21549 2/20 0.52
KMT2A Q03164 4/20 0.43
MAOB P27338 5/20 0.42
APP P05067 1/20 0.42
MEN1 O00255 3/20 0.42
NR4A2 P43354 1/20 0.42
MAPT P10636 1/20 0.42
SLC6A4 P31645 1/20 0.41
MAOA P21397 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA9 Q16790 1/20 0.41
TAAR1 Q96RJ0 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
SCHEMBL3092949 0.79 IDO1 (0.50) IDO1KMT2AAPPMEN1CA2
SCHEMBL2096495 0.78 TAAR1 (0.45) IDO1AGXTKMT2AMAOBMAOA
SCHEMBL17803203 0.77 ABAT (0.46) MAOBMAPTCA1CA2CA9
SCHEMBL513966 0.77 CYP3A4 (0.52) IDO1APP
SCHEMBL6949336 0.77 RXRA (0.42) KMT2AMAPTCA2TAAR1ALDH1A1
SCHEMBL177563 0.77 ALDH1A1 (0.44) KMT2AMAOBAPPMEN1MAPT
SCHEMBL8480 0.77 IDO1 (0.52) IDO1KMT2AMAOBAPPMAPT
SCHEMBL95538 0.77 IDO1 (0.52) IDO1AGXTMAOBAPPNR4A2
SCHEMBL513841 0.77 AGXT (0.52) IDO1AGXTMAOBMAPTMAOA
SCHEMBL5545453 0.77 IDO1 (0.52) IDO1AGXTMAPTALDH1A1

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

Appears in 5701 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107056767-B Process and intermediates for the preparation of water-soluble taxane derivatives 江苏恩华络康药物研发有限公司 2022-07-15 CN claimed
EP-2788353-B1 CAGE AMINE LIGANDS FOR METALLO-RADIOPHARMACEUTICALS Clarity Pharmaceuticals Ltd (AU) 2022-05-18 EP claimed
EP-3053944-B1 METHOD FOR PRODUCING POLYALKYLENE GLYCOL DERIVATIVE HAVING AMINO GROUP AT END, POLYMERIZATION INITIATOR FOR USE IN THE SAME, AND ALCOHOL COMPOUND AS RAW MATERIAL FOR THE POLYMERIZATION INITIATOR SHINETSU CHEMICAL CO (JP) 2021-10-06 EP claimed
US-20210300932-A1 CYCLIC PEPTIDES TARGETING ALPHA-4-BETA-7 INTEGRIN ZEALAND PHARMA A/S (DK) 2021-09-30 US claimed
US-11072616-B2 Cyclic peptides targeting alpha-4-beta-7 integrin UNIVERSITE DE MONTREAL (CA) 2021-07-27 US claimed
CN-107922329-B Process and intermediates for the preparation of water-soluble taxane derivatives 江苏恩华络康药物研发有限公司 2020-11-24 CN claimed
CN-108147972-B Preparation method of vipatavir intermediate and analogue thereof 成都西岭源药业有限公司 2020-07-10 CN claimed
US-9822146-B2 Process for the manufacture of degarelix and its intermediates FERRING B.V. (NL) 2017-11-21 US claimed
EP-2461805-B1 SPECTINAMIDES AS ANTI-TUBERCULOSIS AGENTS UNIV TENNESSEE RES FOUND (US) 2017-11-01 EP claimed
EP-1845078-B1 PROCESS FOR PRODUCING LARGE CYCLIC KETONE AND INTERMEDIATE THEREFOR TAKASAGO PERFUMERY CO LTD (JP) 2017-06-07 EP claimed
EP-0021585-B1 TRUNCATED SOMATOSTATIN ANALOGS AND INTERMEDIATES THEREFOR, PROCESSES FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE ANALOGS AMERICAN HOME PRODUCTS CORPORATION (US) 1983-01-19 EP claimed
US-4281107-A PARTICULARLY 5,6-DIDEOXYNEAMINE, USEFUL AS AN ANTIMICROBIAL AGENT SUAMI T 1981-07-28 US claimed
US-4278676-A NERVOUS SYSTEM DISORDERS, CYCLIZATION, HYDROLYSIS H. LUNDBECK & CO. A/S (DK) 1981-07-14 US claimed
EP-0021585-A1 Truncated somatostatin analogs and intermediates therefor, processes for their preparation, and pharmaceutical compositions containing the analogs AMERICAN HOME PRODUCTS CORPORATION (US) 1981-01-07 EP claimed
EP-0011283-A1 New lactyl tetrapeptide, processes for preparation thereof and pharmaceutical compositions containing it FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-05-28 EP claimed
EP-0008196-A1 Pentapeptides, processes for their preparation, intermediates used in such processes, use in pharmaceutical compositions and compositions containing them AMERICAN HOME PRODUCTS CORPORATION (US) 1980-02-20 EP claimed
US-4169939-A PROCESSES FOR THE PRODUCTION OF 3',4'-DIDEOXYKANAMYCIN B ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1979-10-02 US claimed
US-4129719-A ANTIBIOTICS SUAMI T 1978-12-12 US claimed
US-4125706-A Novel process for the preparation of 1-N-(alpha-substituted-omega-aminoacyl)-3'-deoxyribostamycin ZAIDAN HOJIN BISEIBUTSU KAGAKU KENKYU KAI (JP) 1978-11-14 US claimed
US-4103082-A ANTIMICROBIAL SUAMI T 1978-07-25 US claimed