SCHEMBL646947

SCHEMBL646947

O=Cc1cc(Br)cc(C=O)c1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
ERN1 O75460 4/20 0.41
CYP2A6 P11509 2/20 0.36
KDM4E B2RXH2 1/20 0.35
PTGS2 P35354 1/20 0.35
RAB9A P51151 1/20 0.35
APP P05067 1/20 0.34
MAOA P21397 2/20 0.33
MAOB P27338 2/20 0.33
ALDH1A3 P47895 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ALDH5A1 P51649 1/20 0.33
ABAT P80404 1/20 0.33
HSD17B3 P37058 1/20 0.32

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
SCHEMBL708554 0.94 ALDH1A1 (0.56) ALDH1A1ERN1CYP2A6KDM4EPTGS2
SCHEMBL21169399 0.87 ALDH1A1 (0.46) ALDH1A1ERN1
SCHEMBL31039374 0.87 ALDH1A1 (0.46) ALDH1A1ERN1
SCHEMBL308093 0.83 ALDH1A1 (0.47) ALDH1A1CYP2A6KDM4EPTGS2RAB9A
SCHEMBL237896 0.82 ALDH1A1 (0.46) ALDH1A1ERN1HSD17B10
SCHEMBL1072176 0.82 ALDH1A1 (0.46) ALDH1A1ERN1
SCHEMBL613761 0.82 ALDH1A1 (0.46) ALDH1A1ERN1
SCHEMBL13893901 0.82 ALDH1A1 (0.46) ALDH1A1ERN1
SCHEMBL668005 0.82 ALDH1A1 (0.46) ALDH1A1ERN1KDM4EPTGS2RAB9A
SCHEMBL1996468 0.82 ALDH1A1 (0.46) ALDH1A1ERN1CYP2A6ALDH1A3

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 145 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122037464-A Corrosion-resistant anchor ear and preparation method thereof 河北西左电力设备制造有限公司 2026-05-15 CN claimed
CN-120005135-A Acylhydrazone covalent organic framework material and preparation method and application thereof 东华大学 2025-05-16 CN claimed
CN-118240568-B Preparation method of flame retardant applied to lithium battery 杭州云上新材有限公司 2024-09-27 CN claimed
CN-118527668-A Method for preparing efficient stable metal nanoclusters by using dialdehyde small molecules 吉林大学 2024-08-23 CN claimed
CN-118047719-B Be used for Abeta1-42Preparation and application of quinolinium photosensitizer for protein imaging and viscosity imaging 华南理工大学 2024-06-28 CN claimed
CN-118240568-A Preparation method of flame retardant applied to lithium battery 杭州云上新材有限公司 2024-06-25 CN claimed
CN-118126329-A Polymer electrolyte and preparation method and application thereof 中山大学 2024-06-04 CN claimed
CN-118047719-A Be used for Abeta1-42Preparation and application of quinolinium photosensitizer for protein imaging and viscosity imaging 华南理工大学 2024-05-17 CN claimed
CN-117924116-A Preparation method and application of compound with compression color-changing property 天津理工大学 2024-04-26 CN claimed
CN-117384357-A Binuclear cobalt heterogeneous catalyst 天津理工大学 2024-01-12 CN claimed
CN-113773330-B Azo phenyl organic cage compound, and preparation method and application thereof 国家纳米科学中心 2023-05-23 CN claimed
CN-115873256-A Crosslinked polydimethylsiloxane elastomer material and preparation method thereof 四川大学 2023-03-31 CN claimed
CN-113969096-B High-strength room-temperature self-repairing polyurea coating material and preparation method thereof 四川大学 2022-07-05 CN claimed
CN-113773330-A Azophenyl organic cage compound and preparation method and application thereof 国家纳米科学中心 2021-12-10 CN claimed
CN-122080453-A Fiber reinforced wood-plastic product and preparation method thereof 2026-05-26 CN disclosed
CN-122071403-A Synthesis method of 3, 5-bis (difluoromethyl) benzoic acid 武汉誉祥医药科技有限公司 2026-05-22 CN disclosed
CN-122071403-A Synthesis method of 3, 5-bis (difluoromethyl) benzoic acid 武汉誉祥医药科技有限公司 2026-05-22 CN disclosed
EP-1888330-A2 CHEMICAL SENSOR The Regents of the University of Minnesota (US) 2008-02-20 EP disclosed
WO-2006127963-A2 CHEMICAL SENSOR REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2006-11-30 WO disclosed
EP-0384392-A1 Cyanation of haloaromatics utilizing catalysts generated in situ starting with NiCl2 or NiCl2 6H2O OCCIDENTAL CHEMICAL CORPORATION (US) 1990-08-29 EP disclosed