SCHEMBL16625748

SCHEMBL16625748

Cc1ccc2c(c1)C(CCCCCN(CCCN(C)C)CCCN(C)C)(CCCCCN(CCCN(C)C)CCCN(C)C)c1cc(C)ccc1-2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 3/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C19 P33261 1/20 0.35
SIGMAR1 Q99720 1/20 0.32
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
CHRM2 P08172 1/20 0.31
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
CHRM1 P11229 1/20 0.31
CHRM3 P20309 1/20 0.31
PDK2 Q15119 2/20 0.31
METAP1 P53582 2/20 0.31
HRH1 P35367 1/20 0.31
KCNH2 Q12809 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
CA12 O43570 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30

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
SCHEMBL16252198 1.00 CYP2D6 (0.35) CYP2D6CYP1A2CYP2C19SIGMAR1ALDH1A1
SCHEMBL16204114 1.00 CYP2D6 (0.35) CYP2D6CYP1A2CYP2C19SIGMAR1ALDH1A1
SCHEMBL17147236 1.00 CYP2D6 (0.35) CYP2D6CYP1A2CYP2C19SIGMAR1ALDH1A1
SCHEMBL16625751 0.94 CYP2D6 (0.39) CYP2D6CYP1A2CYP2C19SIGMAR1ALDH1A1
SCHEMBL18101995 0.94 CYP2D6 (0.39) CYP2D6CYP1A2CYP2C19SIGMAR1ALDH1A1
SCHEMBL17147230 0.94 CYP1A2 (0.32) CYP2D6CYP1A2CYP2C19PDK2
SCHEMBL17694304 0.90 DNM1 (0.35) ALDH1A1KCNH2
SCHEMBL17147246 0.90 PDK2 (0.33) CYP2D6CYP1A2CYP2C19PDK2
SCHEMBL18101997 0.90 DNM1 (0.35) ALDH1A1KCNH2
SCHEMBL10111204 0.90 CYP2D6 (0.38) CYP2D6CYP1A2CYP2C19SIGMAR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9941422-B2 Organic photoelectric conversion element and solar cell using the same Konica Minolta, Inc. (JP) 2018-04-10 US disclosed
US-9882072-B2 Solar cell and transparent electrode Konica Minolta, Inc. (JP) 2018-01-30 US disclosed
US-9818962-B2 Organic electroluminescent element and method for manufacturing same Konica Minolta, Inc. (JP) 2017-11-14 US disclosed
US-20170110677-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND METHOD FOR MANUFACTURING SAME MERCK PATENT GMBH (DE) 2017-04-20 US disclosed
US-20170005295-A1 LIGHT EXTRACTION LAYERED BODY, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND METHOD FOR MANUFACTURING SAME Konica Minolta, Inc. (JP) 2017-01-05 US disclosed
US-20160111676-A1 ORGANIC ELECTROLUMINESCENCE ELEMENT Konica Minolta, Inc. (JP) 2016-04-21 US disclosed
US-20150096610-A1 ORGANIC PHOTOELECTRIC CONVERSION ELEMENT AND SOLAR CELL USING THE SAME SONY SEMICONDUCTOR SOLUTIONS CORPORATION (JP) 2015-04-09 US disclosed