SCHEMBL2992858

SCHEMBL2992858

CC(c1ccccc1)c1cccc2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 1/20 0.53
ALDH1A1 P00352 2/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
ADRA2A P08913 4/20 0.51
ADRA2B P18089 4/20 0.51
ADRA2C P18825 4/20 0.51
ADRA1A P35348 2/20 0.51
ADRA1D P25100 1/20 0.51
ADRA1B P35368 1/20 0.51
TYR P14679 1/20 0.43

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
SCHEMBL28931321 1.00 SLC6A4 (0.53) SLC6A4ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL2998678 0.87 ALDH1A1 (0.60) SLC6A4ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL5699550 0.85 ESR1 (0.52) ALDH1A1CYP1A2CYP2C9CYP2C19ADRA2A
SCHEMBL4945776 0.82 TYR (0.43) SLC6A4ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL16154383 0.81 TNF (0.50) SLC6A4ADRA2AADRA2BADRA2CADRA1A
SCHEMBL3003495 0.80 TSHR (0.50) SLC6A4ALDH1A1CYP1A2TYR
SCHEMBL11019542 0.80 SLC6A4 (0.50) SLC6A4ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL4658430 0.79 TYR (0.54) CYP2C9ADRA2AADRA2CTYR
SCHEMBL2201483 0.79 SLC6A4 (0.49) SLC6A4ALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL1000547 0.79 SLC6A4 (0.49) SLC6A4ALDH1A1CYP1A2CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115989190-A Liquid formulations for hydrogen storage 阿科玛法国公司 2023-04-18 CN claimed
CN-115835916-A Purification of aromatic liquids 阿科玛法国公司 2023-03-21 CN claimed
CN-115715272-A Liquid formulations for hydrogen storage 阿科玛法国公司 2023-02-24 CN claimed
CN-108699305-B Polymer composition with improved stress whitening resistance 耐克森公司 2022-04-19 CN claimed
EP-3390529-A1 POLYMER COMPOSITION HAVING GREATER RESISTANCE TO STRESS WHITENING Nexans (FR) 2018-10-24 EP claimed
CN-108699305-A Polymer composition with higher stress-whitening resistance 耐克森公司 2018-10-23 CN claimed
EP-1171222-B1 PROCESS FOR REMOVING HYDROGEN SULFIDE FROM GASES CRYSTATECH INC (US) 2004-09-01 EP claimed
US-5955509-A POLY(VINYL N-HETEROCYCLE)-BLOCK-POLY(ALKYLENE OXIDE) COPOLYMERS IN MICELLE CONTAINING PHARMACEUTICAL FORMULATIONS. BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1999-09-21 US claimed
EP-0778882-A1 MULTIPLE-SUBSTITUTED BLEACH ACTIVATORS THE PROCTER & GAMBLE COMPANY (US) 1997-06-18 EP claimed
WO-1996006914-A1 MULTIPLE-SUBSTITUTED BLEACH ACTIVATORS THE PROCTER & GAMBLE COMPANY (US) 1996-03-07 WO claimed
EP-0246506-B1 FLUID COMPOSITION, PROCESS FOR PREPARATION THEREOF AND ITS USE AS AN ELECTRIC INSULATING OIL IDEMITSU KOSAN COMPANY LIMITED (JP) 1992-01-02 EP claimed
JP-62294629-A None JP disclosed
US-12486388-B2 Polymer composition with improved stress whitening resistance NEXANS (FR) 2025-12-02 US disclosed
WO-2023128467-A1 HYDROGEN STORAGE MATERIAL USING NAPHTHALENE-BASED DERIVATIVE AND MANUFACTURING METHOD THEREFOR 경북대학교 산학협력단 2023-07-06 WO disclosed
WO-2023128467-A1 HYDROGEN STORAGE MATERIAL USING NAPHTHALENE-BASED DERIVATIVE AND MANUFACTURING METHOD THEREFOR 경북대학교 산학협력단 2023-07-06 WO disclosed
US-4525290-A Process for improving traction coefficient of traction drive fluid at high temperatures IDEMITSU KOSAN COMPANY LIMITED (JP) 1985-06-25 US disclosed
US-4442027-A Electrical insulating oil composition NIPPON PETROCHEMICALS COMPANY LTD. (JP) 1984-04-10 US disclosed
EP-0047998-A1 Electrically insulating oil composition Nippon Petrochemicals Co., Ltd. (JP) 1982-03-24 EP disclosed
US-3979324-A BENZYLNAPHTHALENE COMPOUND MONSANTO COMPANY (US) 1976-09-07 US disclosed
US-3846331-A SOLVENT COMPOSITION FOR DYES FOR USE IN PRESSURE-SENSITIVE COPYING PAPER KUREHA CHEMICAL IND CO LTD 1974-11-05 US disclosed