SCHEMBL405311

SCHEMBL405311

Clc1ccc2[nH]ccc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 5/20 1.00
NR4A2 P43354 2/20 1.00
F7 P08709 1/20 1.00
LTA4H P09960 1/20 1.00
F3 P13726 1/20 1.00
CMA1 P23946 1/20 0.68
CYP2A6 P11509 2/20 0.56
USP2 O75604 1/20 0.56
GAA P10253 1/20 0.56
ALOX15 P16050 1/20 0.56
RAD51 Q06609 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
F11 P03951 1/20 0.50
CSNK2A1 P68400 1/20 0.50
IMPDH2 P12268 1/20 0.50
IMPDH1 P20839 1/20 0.50
ALDH1A1 P00352 1/20 0.50
NPC1 O15118 1/20 0.50
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49

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
SCHEMBL30587351 1.00 AHR (1.00) AHRNR4A2F7LTA4HF3
Hydrogen Sulfide SCHEMBL28281607 0.98 AHR (0.95) AHRNR4A2F7LTA4HF3
Methane SCHEMBL27929622 0.98 AHR (0.95) AHRNR4A2F7LTA4HF3
Cyanide SCHEMBL31107496 0.94 AHR (0.88) AHRNR4A2F7LTA4HF3
SCHEMBL6345528 0.92 AHR (0.84) AHRNR4A2F7LTA4HF3
Biphenyl SCHEMBL27962663 0.88 AHR (0.78) AHRNR4A2F7LTA4HF3
Formic Acid SCHEMBL28408351 0.88 AHR (0.78) AHRNR4A2F7LTA4HF3
Acetic Acid SCHEMBL9120196 0.87 F7 (0.75) AHRNR4A2F7LTA4HF3
4-Chloroaniline SCHEMBL11084468 0.85 AHR (0.72) AHRNR4A2F7LTA4HF3
Pyridine SCHEMBL28523689 0.85 AHR (0.72) AHRNR4A2F7LTA4HF3

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 2031 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250170127-A1 RE-SENSITIZING MULTIDRUG-RESISTANT (MDR) GRAM-NEGATIVE BACTERIA TO COLISTIN USING IONOPHORES UNIV COLORADO REGENTS (US) 2025-05-29 US claimed
CN-119977950-A Ubiquitin-specific protease 28 small molecule inhibitor and preparation method and application thereof 郑州大学第一附属医院 2025-05-13 CN claimed
CN-119857098-A Application of indole triazole derivative in preparation of drug-resistant candida albicans drug 云南中医药大学 2025-04-22 CN claimed
EP-4526426-A2 METHODS FOR PRODUCING MONOTERPENE INDOLE ALKALOIDS Danmarks Tekniske Universitet (DK) 2025-03-26 EP claimed
EP-4482494-A1 RE-SENSITIZING MULTIDRUG-RESISTANT (MDR) GRAM-NEGATIVE BACTERIA TO COLISTIN USING IONOPHORES THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2025-01-01 EP claimed
CN-119081799-A Photoresist cleaning solution and preparation method and application thereof 上海盛剑微电子有限公司 2024-12-06 CN claimed
EP-3356387-B1 ANTIMICROBIAL POLYMYXIN DERIVATIVE COMPOUNDS UNIV MONASH (AU) 2024-06-26 EP claimed
CN-118125960-A Bisindole 3-ketone compound, application and preparation method thereof 云南农业大学 2024-06-04 CN claimed
CN-118063373-A 3,3' -Bisindole compound and application and preparation method thereof 云南农业大学 2024-05-24 CN claimed
CN-118056816-A Pyrazole-3-ketone derivative, and preparation method and application thereof 沈阳药科大学 2024-05-21 CN claimed
JP-3272357-B2 2002-04-08 JP claimed
US-5430148-A Antiproliferative quinazolines AGOURON PHARMACEUTICALS, INC. (US) 1995-07-04 US claimed
EP-0637300-A1 ANTIPROLIFERATIVE QUINAZOLINES AGOURON PHARMACEUTICALS, INC. (US) 1995-02-08 EP claimed
CN-1081676-A The indoles and the indazole derivatives that are used for the treatment and the prevention of cerebral disorders, their preparation and application SANKYO CO (JP) 1994-02-09 CN claimed
WO-1993020055-A1 ANTIPROLIFERATIVE QUINAZOLINES AGOURON PHARMACEUTICALS, INC. (US) 1993-10-14 WO claimed
US-4925901-A STORAGE STAABILITY, ONIUM ION CATALYST THE DOW CHEMICAL COMPANY (US) 1990-05-15 US claimed
WO-1989003691-A1 POTENTIATION OF ANTIHYPERTENSIVE EFFECT OF ACE INHIBITORS CIBA-GEIGY AG (CH) 1989-05-05 WO claimed
US-4377699-A REACTING INDOLINE WITH AN ORGANIC CARBOXYLIC ACID ACYLATING AGENT, CHLORINATION, SAPONIFICATION, FOLLOWED BY OXIDATION WITH AN AROMATIC NITRO COMPOUND RUTGERSWERKE AKTIENGESELLSCHAFT (DE) 1983-03-22 US claimed
US-4360594-A REACTING INDOLE COMPOUND WITH SERINE, OR WITH PYRUVIC ACID AND AMMONIUM ION ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1982-11-23 US claimed
US-4349627-A Process for producing L-tryptophan or derivatives thereof using a microorganism ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1982-09-14 US claimed