SCHEMBL12753

SCHEMBL12753

c1ccc2c(c1)cc1c3c(cccc32)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.48
HPGD P15428 9/20 0.48
HSD17B10 Q99714 8/20 0.48
KDM4E B2RXH2 8/20 0.48
MEN1 O00255 4/20 0.48
KMT2A Q03164 4/20 0.48
LMNA P02545 3/20 0.48
MAPT P10636 3/20 0.48
GAA P10253 2/20 0.48
CYP1A2 P05177 2/20 0.48
HIF1A Q16665 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
TSHR P16473 2/20 0.48
MAPK1 P28482 2/20 0.48
ERBB2 P04626 1/20 0.48
FYN P06241 1/20 0.48
MAOA P21397 1/20 0.48
ACHE P22303 1/20 0.48
AHR P35869 1/20 0.48
CASP1 P29466 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
SCHEMBL29765599 1.00 ALDH1A1 (0.48) ALDH1A1HPGDHSD17B10KDM4EMEN1
Fluoranthene SCHEMBL29286799 0.89 ALDH1A1 (0.58) ALDH1A1HPGDHSD17B10KDM4EMEN1
SCHEMBL28829633 0.82 ALDH1A1 (0.44) ALDH1A1HPGDHSD17B10KDM4EMEN1
Benzo[Def]Chrysene SCHEMBL1557634 0.80 CYP1A2 (0.76) ALDH1A1HPGDHSD17B10KDM4EMEN1
Phenanthrene SCHEMBL27970728 0.78 ALDH1A1 (0.55) ALDH1A1HPGDHSD17B10KDM4EMEN1
Acenaphthene SCHEMBL28444594 0.78 ALDH1A1 (0.50) ALDH1A1HPGDHSD17B10KDM4EMEN1
SCHEMBL28474141 0.76 ALDH1A1 (0.46) ALDH1A1HPGDHSD17B10KDM4EMAPT
SCHEMBL8955 0.76 CYP1A2 (0.46) ALDH1A1HPGDHSD17B10KDM4EMEN1
SCHEMBL5552753 0.73 ALDH1A1 (0.52) ALDH1A1HPGDHSD17B10KDM4EMEN1
SCHEMBL1618426 0.73 HPGD (0.46) ALDH1A1HPGDHSD17B10KDM4EMEN1

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 1186 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110785376-B Surface-modified inorganic nitride, composition, heat-conducting material and device with heat-conducting layer 富士胶片株式会社 2023-03-31 CN claimed
CN-111801317-A Template-directed nucleic acid-targeting compounds 卡耐基梅隆大学 2020-10-20 CN claimed
CN-111757935-A Bivalent nucleic acid ligand and use thereof 卡耐基梅隆大学 2020-10-09 CN claimed
CN-110785376-A Surface-modified inorganic nitride, composition, heat-conducting material and device with heat-conducting layer 富士胶片株式会社 2020-02-11 CN claimed
EP-2421809-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS Canon Kabushiki Kaisha (JP) 2012-02-29 EP claimed
WO-2010123153-A1 NOVEL ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, AND IMAGE DISPLAY APPARATUS CANON KABUSHIKI KAISHA (JP) 2010-10-28 WO claimed
US-5403908-A Aryl styrene-based copolymer IDEMITSU KOSAN COMPANY, LIMITED (JP) 1995-04-04 US claimed
EP-0182609-B1 POLYCYCLIC BIOCIDAL COMPOUNDS, THEIR SYNTHESIS, FORMULATIONS CONTAINING THEM THE WELLCOME FOUNDATION LIMITED (GB) 1990-05-09 EP claimed
US-4827034-A ANTITUMOR BURROUGHS WELLCOME CO. (US) 1989-05-02 US claimed
EP-0182609-A2 Polycyclic biocidal compounds, their synthesis, formulations containing them THE WELLCOME FOUNDATION LIMITED (GB) 1986-05-28 EP claimed
CN-117586195-B Organic luminescent material, organic electroluminescent device and preparation thereof SHANGHAI UNIVERSITY (CN) 2026-05-29 CN disclosed
CN-122079730-A Organic compound and organic light-emitting element 2026-05-26 CN disclosed
CN-122094947-A PARP1 inhibitor compounds 2026-05-26 CN disclosed
WO-2026106969-A1 NOVEL INHIBITORS OF INTERLEUKIN RECEPTOR- ASSOCIATED KINASE UNIVERSITY OF ROCHESTER (US) 2026-05-21 WO disclosed
CN-116406355-B P38 alpha mitogen-activated protein kinase inhibitors GEN1E生命科学公司 2026-05-15 CN disclosed
US-5403908-A Aryl styrene-based copolymer IDEMITSU KOSAN COMPANY, LIMITED (JP) 1995-04-04 US disclosed
EP-0519406-A2 Novel perfluoropolyether derivatives, and lubricants and magnetic recording medium using the same SONY CORPORATION (JP) 1992-12-23 EP disclosed
EP-0444210-A1 ARYLSTYRENE POLYMER AND COPOLYMER AND PROCESS FOR PREPARING THE SAME IDEMITSU KOSAN COMPANY LIMITED (JP) 1991-09-04 EP disclosed
EP-0182609-B1 POLYCYCLIC BIOCIDAL COMPOUNDS, THEIR SYNTHESIS, FORMULATIONS CONTAINING THEM THE WELLCOME FOUNDATION LIMITED (GB) 1990-05-09 EP disclosed
EP-0182609-A2 Polycyclic biocidal compounds, their synthesis, formulations containing them THE WELLCOME FOUNDATION LIMITED (GB) 1986-05-28 EP disclosed