SCHEMBL193825

SCHEMBL193825

O=CNc1ccc2ccccc2c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
CYP1A2 P05177 3/20 0.52
CYP3A4 P08684 2/20 0.52
HSD17B10 Q99714 2/20 0.52
CYP2C19 P33261 2/20 0.52
HIF1A Q16665 2/20 0.52
HPGD P15428 1/20 0.52
CYP2D6 P10635 1/20 0.52
CYP2C9 P11712 1/20 0.52
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
RAB9A P51151 7/20 0.48
NPC1 O15118 6/20 0.48
MAPT P10636 2/20 0.48
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
POLB P06746 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
LMNA P02545 1/20 0.47

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
SCHEMBL28305711 0.98 ALDH1A1 (0.52) ALDH1A1CYP1A2CYP3A4HSD17B10CYP2C19
SCHEMBL28870757 0.94 ALDH1A1 (0.52) ALDH1A1CYP1A2CYP3A4HSD17B10CYP2C19
SCHEMBL5315761 0.94 ALDH1A1 (0.52) ALDH1A1CYP1A2CYP3A4HSD17B10CYP2C19
Hydrochloric Acid SCHEMBL27301426 0.92 ALDH1A1 (0.50) ALDH1A1CYP1A2CYP3A4HSD17B10CYP2C19
SCHEMBL27689981 0.91 ALDH1A1 (0.50) ALDH1A1CYP1A2CYP3A4HSD17B10CYP2C19
SCHEMBL27962728 0.83 ALDH1A1 (0.47) ALDH1A1CYP1A2HSD17B10HIF1AHPGD
SCHEMBL28175324 0.82 ALDH1A1 (0.50) ALDH1A1CYP1A2CYP3A4HSD17B10CYP2C19
Naphthalene SCHEMBL29118150 0.79 ALDH1A1 (0.85) ALDH1A1CYP3A4HSD17B10HPGDRAB9A
SCHEMBL12175387 0.79 ALDH1A1 (0.45) ALDH1A1CYP3A4HSD17B10HIF1ACA1
SCHEMBL17430186 0.79 CYP2A6 (0.45) ALDH1A1CA1CA2RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119754055-A Preparation process of bio-based PA 510-tencel blended fabric 江苏苏美达轻纺科技产业有限公司 2025-04-04 CN claimed
CN-117924207-A Epoxy resin flexible film with high glass transition temperature 中国科学院深圳先进技术研究院 2024-04-26 CN claimed
CN-110278711-A TRICYCLIC SULFONES AS ROR GAMMA MODULATORS 百时美施贵宝公司 2019-09-24 CN claimed
CN-108752236-A SHIP1 conditioning agents and relative method 阿奎诺克斯药物(加拿大)公司 2018-11-06 CN claimed
CN-107383667-A A kind of formula and its processing method for adjusting seat material 徐州苏牌高温新材料有限公司 2017-11-24 CN claimed
CN-106957618-A Resistant to elevated temperatures colored particularly orange adhesive tape and methods for making them and carrier and the bunch of cables with such adhesive tape 科络普拉斯特弗里茨米勒有限公司 2017-07-18 CN claimed
WO-2008017840-A1 CYCLOPENTANECARBOXYLIC ACID DERIVATIVES AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTIOUS DISEASES MERLION PHARMACEUTICALS SA (CH) 2008-02-14 WO claimed
US-6380197-B1 FOR TREATING AND PREVENTING A PLETHORA OF DISEASES INCLUDING DIABETES AVENTIS PHARMA S. A. (FR) 2002-04-30 US claimed
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP claimed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US claimed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO claimed
EP-0520336-A2 Aldehyde derivatives and their use as calpain inhibitors FUJIREBIO Inc. (JP) 1992-12-30 EP claimed
US-4886813-A INHIBITORS OF ANGIOTENSIN CONVERTING ENZYME OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) 1989-12-12 US claimed
EP-0233841-A1 Quinone derivatives and process for their preparation Arai, Tadashi, Prof. (JP) 1987-08-26 EP claimed
CN-119754055-A Preparation process of bio-based PA 510-tencel blended fabric 江苏苏美达轻纺科技产业有限公司 2025-04-04 CN disclosed
CN-119039149-A Method for preparing aromatic methylamine 鞍山七彩化学股份有限公司 2024-11-29 CN disclosed
CN-117229207-B Phenyl naphthalene compound and preparation and application thereof 浙江工业大学 2024-09-03 CN disclosed
EP-0233841-A1 Quinone derivatives and process for their preparation Arai, Tadashi, Prof. (JP) 1987-08-26 EP disclosed
US-4222959-A Process for the preparation of aromatic formamides ATLANTIC RICHFIELD COMPANY (US) 1980-09-16 US disclosed
US-3935195-A FLUORESCENT DYE STERLING DRUG INC. (US) 1976-01-27 US disclosed