SCHEMBL5047700

SCHEMBL5047700

c1ccc2c(c1)-c1ccc3ccccc3c1-2

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 1/20 0.69
ALDH1A1 P00352 6/20 0.52
HSD17B10 Q99714 4/20 0.52
TSHR P16473 4/20 0.52
CYP2A6 P11509 2/20 0.52
TDP1 Q9NUW8 1/20 0.52
MAPT P10636 2/20 0.50
ANPEP P15144 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HPRT1 P00492 1/20 0.48
HIF1A Q16665 3/20 0.44
CYP1B1 Q16678 1/20 0.44
WDR5 P61964 1/20 0.43
CES1 P23141 3/20 0.42
MAPK1 P28482 3/20 0.42
HPGD P15428 2/20 0.42
CYP1A2 P05177 2/20 0.42

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
SCHEMBL31045609 1.00 DNMT1 (0.69) DNMT1ALDH1A1HSD17B10TSHRCYP2A6
SCHEMBL30021838 0.89 DNMT1 (0.58) DNMT1ALDH1A1HSD17B10TSHRCYP2A6
SCHEMBL30022671 0.89 DNMT1 (0.58) DNMT1ALDH1A1HSD17B10TSHRCYP2A6
SCHEMBL25405267 0.89 DNMT1 (0.58) DNMT1ALDH1A1HSD17B10TSHRCYP2A6
SCHEMBL25404542 0.88 DNMT1 (0.56) DNMT1ALDH1A1HSD17B10TSHRCYP2A6
Benzene SCHEMBL29177884 0.88 DNMT1 (0.56) DNMT1ALDH1A1HSD17B10TSHRCYP2A6
SCHEMBL14777719 0.87 DNMT1 (0.64) DNMT1ALDH1A1HSD17B10TSHRCYP2A6
SCHEMBL30332956 0.86 DNMT1 (0.55) DNMT1ALDH1A1HSD17B10TSHRCYP2A6
SCHEMBL196007 0.86 DNMT1 (0.59) DNMT1ALDH1A1HSD17B10TSHRCYP2A6
SCHEMBL29787010 0.86 DNMT1 (0.59) DNMT1ALDH1A1HSD17B10TSHRCYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015086793-A1 POLYMER SUPPORTED PHOSPHORIC ACIDS AND USE THEREOF AS CATALYSTS IN THE PREPARATION OF 3-INDOLYLMETHANAMINES FUNDACIÓ INSTITUT CATALÀ D'INVESTIGACIÓ QUÍMICA (ICIQ) (ES) 2015-06-18 WO claimed
EP-2883879-A1 Polymer supported phosphoric acids and use thereof as catalysts in the preparation of 3-indolylmethanamines Fundació Institut Català d'Investigació Química (ES) 2015-06-17 EP claimed
EP-2155760-B1 ORGANIC METAL COMPLEXES DERIVATIVE AND ORGANIC LIGHT EMITTING DEVICES USING THE SAME LG CHEMICAL LTD (KR) 2014-03-05 EP claimed
US-7317066-B2 Liquid crystal polymers RENSSELAER POLYTECHNIC INSTITUTE (US) 2008-01-08 US claimed
US-20060293490-A1 Liquid crystal polymers BENICEWICZ BRIAN 2006-12-28 US claimed
US-20050197483-A1 Liquid crystal polymers RENSSELAER POLYTECHNIC INSTITUTE (US) 2005-09-08 US claimed
CN-115521435-B Resin, curable resin composition, cured product, insulating material, and resist member DIC株式会社 2024-02-09 CN disclosed
CN-117510395-A Deuterated composition, organic electroluminescent device and display device 阜阳欣奕华材料科技有限公司 2024-02-06 CN disclosed
CN-117510509-A Deuterated composition, intermediate and application 阜阳欣奕华材料科技有限公司 2024-02-06 CN disclosed
CN-117229256-A Deuterated composition, organic electroluminescent device and display device 阜阳欣奕华材料科技有限公司 2023-12-15 CN disclosed
CN-116969924-A Deuterated composition, organic electroluminescent device and display device 阜阳欣奕华材料科技有限公司 2023-10-31 CN disclosed
CN-116903629-A Deuterated composition, organic electroluminescent device and display device 阜阳欣奕华材料科技有限公司 2023-10-20 CN disclosed
EP-3093287-A1 AN IODINE CATALYSED PROCESS FOR PREPARING HETEROCYCLIC NITROGEN-CONTAINING COMPOUNDS Fundació Institut Català D'investigació Quimica (ES) 2016-11-16 EP disclosed
EP-0361416-A1 Polyamides prepared from 2-(3-aminophenyl)-2-(4-aminophenyl) hexafluoro propane HOECHST CELANESE CORPORATION (US) 1990-04-04 EP disclosed
EP-0361415-A1 Polymers prepared from 2-(3-aminophenyl)-2-(4-aminophenyl) hexafluoro propane HOECHST CELANESE CORPORATION (US) 1990-04-04 EP disclosed
US-4914180-A Polyamides prepared from 2-(3-aminophenyl)-2-(4-aminophenyl) hexafluoro propane HOECHST CELANESE CORPORATION (US) 1990-04-03 US disclosed
EP-0349265-A2 Electroluminescent devices EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1990-01-03 EP disclosed
EP-0281381-A2 Electroluminescent device with modified thin film luminescent zone EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1988-09-07 EP disclosed
US-4177192-A DETERGENCY, VISCOSITY CONTROL, AND CORROSION RESISTANCE TO LUBRICANTS MOBIL OIL CORPORATION (US) 1979-12-04 US disclosed
US-4053425-A LUBRICANT ADDITIVES MOBIL OIL CORPORATION (US) 1977-10-11 US disclosed