SCHEMBL202182

SCHEMBL202182

Nc1ccc2ccc(N)cc2c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.72
CYP3A4 P08684 5/20 0.72
HSD17B10 Q99714 3/20 0.72
CASP1 P29466 4/20 0.68
HIF1A Q16665 3/20 0.68
CASP7 P55210 2/20 0.68
HBB P68871 2/20 0.68
TDP1 Q9NUW8 2/20 0.68
ALOX15 P16050 1/20 0.68
MEN1 O00255 6/20 0.57
KMT2A Q03164 6/20 0.57
KDM4E B2RXH2 6/20 0.57
MAPT P10636 6/20 0.57
HTT P42858 4/20 0.52
LMNA P02545 3/20 0.52
F2 P00734 1/20 0.52
CHRM2 P08172 1/20 0.52
HTR1A P08908 1/20 0.52
ADRA2A P08913 1/20 0.52
ADORA3 P0DMS8 1/20 0.52

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
SCHEMBL29468144 1.00 ALDH1A1 (0.72) ALDH1A1CYP3A4HSD17B10CASP1HIF1A
SCHEMBL3412594 0.97 ALDH1A1 (0.78) ALDH1A1CYP3A4HSD17B10CASP1HIF1A
Naphthalene SCHEMBL3939830 0.91 ALDH1A1 (0.89) ALDH1A1CYP3A4HSD17B10CASP1HIF1A
SCHEMBL442351 0.90 ALDH1A1 (0.83) ALDH1A1CYP3A4HSD17B10CASP1HIF1A
SCHEMBL29165604 0.90 ALDH1A1 (0.83) ALDH1A1CYP3A4HSD17B10CASP1HIF1A
SCHEMBL2893484 0.90 ALDH1A1 (0.83) ALDH1A1CYP3A4HSD17B10CASP1HIF1A
SCHEMBL30413338 0.90 ALDH1A1 (0.83) ALDH1A1CYP3A4HSD17B10CASP1HIF1A
SCHEMBL145891 0.89 ALDH1A1 (0.77) ALDH1A1CYP3A4HSD17B10CASP1HIF1A
SCHEMBL29367325 0.89 ALDH1A1 (0.77) ALDH1A1CYP3A4HSD17B10CASP1HIF1A
Fluoride SCHEMBL27620141 0.86 ALDH1A1 (0.72) ALDH1A1CYP3A4HSD17B10CASP1HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024212818-A1 PREPARATION METHOD FOR ANTI-STATIC POLYIMIDE RESIN 黄山聚鑫新材料有限公司 2024-10-17 WO claimed
CN-118271567-A Preparation method of hyperbranched modified poly (urethane-acrylic) resin and application of hyperbranched modified poly (urethane-acrylic) resin in cold-stamping connecting material 江苏众立生包装科技有限公司 2024-07-02 CN claimed
CN-117736606-B Preparation method of water-based ink containing modified polyurea 江苏众立生包装科技有限公司 2024-05-17 CN claimed
CN-116554486-B Clover type adsorbent for high-selectivity adsorption of cobalt ions and preparation method thereof 合肥普力先进材料科技有限公司 2024-05-17 CN claimed
CN-117736606-A Preparation method of water-based ink containing modified polyurea 江苏众立生包装科技有限公司 2024-03-22 CN claimed
CN-116333312-B Preparation method of antistatic polyimide resin 黄山聚鑫新材料有限公司 2023-12-22 CN claimed
CN-114478970-B Precursor composition of covalent organic framework material and application thereof 中国科学院大连化学物理研究所 2023-11-03 CN claimed
CN-116920915-A Cyano carbon quantum dot/carbon nitride nano sheet and preparation method and application thereof 上海大学 2023-10-24 CN claimed
CN-116874839-A Preparation method of polyimide film with low thermal expansion coefficient for copper-clad plate 黄山金石木塑料科技有限公司 2023-10-13 CN claimed
CN-116554486-A Clover type adsorbent for high-selectivity adsorption of cobalt ions and preparation method thereof 杭州普力材料科技有限公司 2023-08-08 CN claimed
EP-0577245-B1 Photogenerating azo pigments XEROX CORP (US) 1998-12-02 EP claimed
CN-1189094-A Hair care products with at least one conditioner SCHWARZKOPF GMBH HANS (DE) 1998-07-29 CN claimed
EP-0835093-A1 HAIR DYE AGENTS WITH AT LEAST ONE CONDITIONER Hans Schwarzkopf GmbH & Co. KG (DE) 1998-04-15 EP claimed
WO-1998014501-A1 PROCESS FOR THE PREPARATION OF THERMOTROPIC AROMATIC POLYESTERS DIRECTLY FROM DIALKYL AROMATIC ESTERS HOECHST CELANESE CORPORATION (US) 1998-04-09 WO claimed
US-5731401-A ONE STEP; HIGH MOLECULAR WEIGHT HOECHST CELANESE CORP. (US) 1998-03-24 US claimed
WO-1997001323-A1 HAIR DYE AGENTS WITH AT LEAST ONE CONDITIONER HANS SCHWARZKOPF GMBH (DE) 1997-01-16 WO claimed
EP-0693499-A1 Glycosaminoglycan derivative, copolymer gel of acrylamide and said derivative and process for identifying enzyme SEIKAGAKU KOGYO KABUSHIKI KAISHA (SEIKAGAKU CORPORATION) (JP) 1996-01-24 EP claimed
US-5411675-A Mixtures of aromatic diamines, hydroxynaphthoquinone, acid and silica sol as antiscaling agents SHIN-ETSU CHEMICAL CO., LTD. (JP) 1995-05-02 US claimed
US-5281503-A Multilayer element with disazo pigments and charge generating layer XEROX CORPORATION (US) 1994-01-25 US claimed
EP-0577245-A1 Photogenerating azo pigments XEROX CORPORATION (US) 1994-01-05 EP claimed