SCHEMBL8644430

SCHEMBL8644430

CC(Cc1ccccc1)c1ccc(OC#N)cc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
MAOB P27338 2/20 0.41
ALDH1A1 P00352 1/20 0.40
TAAR1 Q96RJ0 4/20 0.39
SLC6A2 P23975 2/20 0.39
SIGMAR1 Q99720 2/20 0.39
MAOA P21397 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
CYP2A6 P11509 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
PBRM1 Q86U86 1/20 0.38
CNR2 P34972 1/20 0.38
BCHE P06276 1/20 0.38
SLC18A2 Q05940 1/20 0.37
CYP2D6 P10635 1/20 0.37

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
SCHEMBL9346982 0.92 ESR1 (0.52) ESR1ESR2ALDH1A1SLC6A4CYP2D6
SCHEMBL17042604 0.92 ESR1 (0.52) ESR1ESR2ALDH1A1SLC6A4CYP2D6
SCHEMBL2868448 0.89 ESR1 (0.39) ESR1ESR2TAAR1BCHE
SCHEMBL18437858 0.85 PBRM1 (0.36) ESR1ESR2MAOBALDH1A1TAAR1
SCHEMBL21049662 0.83 ESR1 (0.39) ESR1ESR2SLC6A4CNR2
SCHEMBL28344005 0.80 ALDH1A1 (0.59) ESR1ESR2ALDH1A1SIGMAR1SLC6A4
SCHEMBL28344007 0.80 ALDH1A1 (0.59) ESR1ESR2ALDH1A1SIGMAR1SLC6A4
Ammonia Solution, Strong SCHEMBL5305768 0.78 ALDH1A1 (0.58) ESR1ESR2ALDH1A1SIGMAR1SLC6A4
SCHEMBL28848265 0.78 MAOB (0.47) ESR1ESR2MAOBTAAR1SLC6A2
SCHEMBL23674283 0.78 PBRM1 (0.42) ESR1ESR2ALDH1A1PBRM1CNR2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5789757-A PACKAGING FOR ELECTRONICS THE DEXTER CORPORATION (US) 1998-08-04 US claimed
CN-107922767-B Ink composition with improved conductivity 汉高知识产权控股有限责任公司 2021-12-21 CN disclosed
CN-108779330-A Resin combination, prepreg, clad with metal foil plywood, resin sheet and printed circuit board 三菱瓦斯化学株式会社 2018-11-09 CN disclosed
CN-107207834-B Resin composition for printed circuit board, prepreg, clad with metal foil plywood, resin sheet and printed circuit board (PCB) 三菱瓦斯化学株式会社 2018-05-29 CN disclosed
CN-107922767-A With the ink composite for improving electric conductivity 汉高知识产权控股有限责任公司 2018-04-17 CN disclosed
US-5789757-A PACKAGING FOR ELECTRONICS THE DEXTER CORPORATION (US) 1998-08-04 US disclosed
US-5753748-A MONOMER VEHICLE CONTAINING ATLEAST ONE POLYISOCYANTE ESTER MONOMER, CATIONIC SURFACTANTS AND METAL CATALYSTS QUANTUM MATERIALS, INC. (US) 1998-05-19 US disclosed
US-5718941-A FOR ADHESIVE COMPOSITIONS QUANTUM MATERIALS, INC. (US) 1998-02-17 US disclosed