SCHEMBL699741

SCHEMBL699741

O=C(C=Cc1ccccc1)c1cccc2ccccc12

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1B1 Q16678 9/20 0.71
CYP1A1 P04798 6/20 0.71
CYP1A2 P05177 1/20 0.71
CYP3A4 P08684 1/20 0.71
CYP2D6 P10635 1/20 0.71
ABCG2 Q9UNQ0 2/20 0.69
MAPT P10636 5/20 0.62
BCHE P06276 2/20 0.62
CYP2C19 P33261 1/20 0.62
LMNA P02545 3/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
KDM4E B2RXH2 1/20 0.58
MEN1 O00255 1/20 0.58
ALDH1A1 P00352 1/20 0.58
TP53 P04637 1/20 0.58
HPGD P15428 1/20 0.58
MAPK1 P28482 1/20 0.58
KMT2A Q03164 1/20 0.58
GPR52 Q9Y2T5 1/20 0.57
NPC1 O15118 1/20 0.56

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
SCHEMBL7913782 1.00 CYP1B1 (0.71) CYP1B1CYP1A1CYP1A2CYP3A4CYP2D6
SCHEMBL13680424 0.95 CYP1B1 (0.68) CYP1B1CYP1A1CYP1A2CYP3A4CYP2D6
SCHEMBL13203438 0.92 CYP1B1 (0.69) CYP1B1CYP1A1CYP1A2CYP3A4CYP2D6
SCHEMBL12306185 0.90 CYP1B1 (0.63) CYP1B1CYP1A1CYP1A2CYP3A4CYP2D6
SCHEMBL8877657 0.87 CYP1B1 (0.72) CYP1B1CYP1A1CYP1A2CYP3A4CYP2D6
SCHEMBL14601354 0.87 MAPT (0.66) CYP1B1CYP1A1CYP1A2CYP3A4CYP2D6
SCHEMBL2754551 0.87 CYP1B1 (0.60) CYP1B1CYP1A1CYP1A2CYP3A4CYP2D6
SCHEMBL7641857 0.87 MAPT (0.66) CYP1B1CYP1A1CYP1A2CYP3A4CYP2D6
SCHEMBL6936903 0.87 CYP1B1 (0.72) CYP1B1CYP1A1CYP1A2CYP3A4CYP2D6
SCHEMBL8877653 0.87 CYP1B1 (0.72) CYP1B1CYP1A1CYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114524829-B Preparation method of imidazo [2,1-b ] thiazole derivative 新疆大学 2024-04-02 CN disclosed
CN-114163290-B Butter inhibitor for alkaline washing tower and preparation method thereof 万华化学集团股份有限公司 2024-02-27 CN disclosed
CN-114524829-A Preparation method of imidazo [2,1-b ] thiazole derivative 新疆大学 2022-05-24 CN disclosed
CN-114163290-A Alkaline washing tower butter inhibitor and preparation method thereof 万华化学集团股份有限公司 2022-03-11 CN disclosed
EP-2538410-B1 METHOD OF RECORDING DATA IN AN OPTICAL DATA STORAGE MEDIUM AND AN OPTICAL DATA STORAGE MEDIUM GEN ELECTRIC (US) 2016-08-10 EP disclosed
US-8778568-B2 Optical data storage media and methods for using the same GENERAL ELECTRIC COMPANY (US) 2014-07-15 US disclosed
US-8703388-B2 Optical data storage media GENERAL ELECTRIC COMPANY (US) 2014-04-22 US disclosed
EP-2466582-B1 Optical Data Storage Media And Methods For Using The Same GEN ELECTRIC (US) 2014-02-26 EP disclosed
US-8507153-B2 Compositions, optical data storage media and methods for using the optical data storage media GENERAL ELECTRIC COMPANY (US) 2013-08-13 US disclosed
EP-2423917-B1 Use of chemically bonded dyes in holographic data storage media GEN ELECTRIC (US) 2013-08-07 EP disclosed
EP-0872903-B1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder SHINETSU CHEMICAL CO (JP) 2001-10-04 EP disclosed
US-6277519-B1 QUENCHING AN ALLOY MELT; COMMINUTION SHIN-ETSU CHEMICAL CO., LTD. (JP) 2001-08-21 US disclosed
US-6096144-A TREATING WITH ACIDIC OR ALKALINE SOLUTION OF CONJUGATED UNSATURATED COMPOUND WITH AT LEAST 5 BONDS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2000-08-01 US disclosed
US-5858571-A TREATING A PULVERIZED HYDROGEN ABSORBING ALLOY WITH A SOLUTION COMPRISING A CONJUGATED UNSATURATED COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 1999-01-12 US disclosed
EP-0872903-A1 Method for making hydrogen storage alloy powder and electrode comprising the alloy powder Shin-Etsu Chemical Co., Ltd. (JP) 1998-10-21 EP disclosed
CN-1006386-B PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER SHINETSU CHEM IND CO (JP) 1990-01-10 CN disclosed
EP-0172427-B1 PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER Shin-Etsu Chemical Co., Ltd. (JP) 1989-07-05 EP disclosed
US-4758639-A Process for production of vinyl polymer SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-19 US disclosed
US-4757124-A Suspension or emulsion polymerizing vinyl chloride monomer or mixture of vinyl chloride with vinyl monomer copolymerizable therewith in reactor with walls coated with antiscaling compound containing dye or pigments SHIN-ETSU CHEMICAL CO., LTD. (JP) 1988-07-12 US disclosed
CN-85107531-A Process for producing vinyl chloride polymer 1987-01-21 CN disclosed