SCHEMBL17147273

SCHEMBL17147273

CC(C)(c1ccc(-n2c3ccncc3c3cnccc32)cc1)c1ccc(C(C)(c2ccccc2)c2ccc(-n3c4ccncc4c4cnccc43)cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.41
ESR1 P03372 3/20 0.37
ESR2 Q92731 3/20 0.37
ALDH1A1 P00352 2/20 0.37
CYP3A4 P08684 1/20 0.37
MAOA P21397 4/20 0.35
MAOB P27338 4/20 0.35
ACHE P22303 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ATM Q13315 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CYP2D6 P10635 1/20 0.34
USP14 P54578 1/20 0.33
FGFR1 P11362 1/20 0.33
REN P00797 2/20 0.33

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
SCHEMBL12113701 0.90 USP14 (0.35) CYP19A1ESR1ESR2CYP3A4MAOA
SCHEMBL12011958 0.89 MAOA (0.47) MAOAMAOBACHEKDM4EATM
SCHEMBL12241437 0.89 MAOA (0.47) MAOAMAOBACHEKDM4EATM
SCHEMBL9968183 0.89 MAOA (0.47) CYP19A1MAOAMAOBACHEKDM4E
SCHEMBL16710935 0.85 MAOA (0.43) ALDH1A1MAOAMAOBACHEKDM4E
SCHEMBL13811428 0.80 MAOA (0.39) ALDH1A1MAOAMAOBACHEKDM4E
SCHEMBL13866625 0.78 ATM (0.56) ALDH1A1MAOAMAOBACHEKDM4E
SCHEMBL12383140 0.77 MAOA (0.37) ALDH1A1MAOAMAOBACHEKDM4E
SCHEMBL19836759 0.77 KDM4E (0.61) ESR1ESR2ALDH1A1CYP3A4KDM4E
SCHEMBL10100891 0.77 KDM4E (0.61) ESR1ESR2ALDH1A1CYP3A4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9935269-B2 Electroluminescence element Konica Minolta, Inc. (JP) 2018-04-03 US disclosed
US-9935269-B2 Electroluminescence element Konica Minolta, Inc. (JP) 2018-04-03 US disclosed
US-20150287927-A1 ELECTROLUMINESCENCE ELEMENT Konica Minolta, Inc. (JP) 2015-10-08 US disclosed
US-20150287927-A1 ELECTROLUMINESCENCE ELEMENT Konica Minolta, Inc. (JP) 2015-10-08 US disclosed