SCHEMBL10703055

SCHEMBL10703055

O=C1c2ccccc2Cc2ccc3c(-c4cccc5c6c(ccc45)Cc4ccccc4C6=O)cccc3c21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.59
CES1 P23141 2/20 0.50
BCHE P06276 1/20 0.50
ALDH1A1 P00352 5/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
MAPT P10636 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
USP2 O75604 1/20 0.43
HPN P05981 1/20 0.43
CYP3A4 P08684 1/20 0.43
ALOX5 P09917 1/20 0.43
THRB P10828 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
PTGS1 P23219 1/20 0.43
PDE4A P27815 1/20 0.43
KDR P35968 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL8205266 0.89 ALDH1A1 (0.53) MAOACES1BCHEALDH1A1CYP1A2
SCHEMBL11385694 0.86 MAOA (0.47) MAOACES1BCHEALDH1A1CYP1A2
SCHEMBL769934 0.83 MAOA (0.71) MAOACES1BCHEALDH1A1CYP1A2
SCHEMBL10756250 0.79 MAOA (0.55) MAOACES1BCHEALDH1A1CYP1A2
SCHEMBL4848751 0.78 MAOA (0.50) MAOACES1BCHEALDH1A1CYP1A2
SCHEMBL5958453 0.78 MAOA (0.53) MAOACES1BCHEALDH1A1CYP1A2
SCHEMBL7742221 0.78 MAOA (0.53) MAOACES1BCHEALDH1A1CYP1A2
SCHEMBL11150519 0.78 MAOA (0.53) MAOACES1BCHEALDH1A1CYP1A2
SCHEMBL8012706 0.78 MAOA (0.53) MAOACES1BCHEALDH1A1CYP1A2
Anthrone SCHEMBL29089221 0.78 MAOA (0.69) MAOACES1BCHEALDH1A1CYP1A2

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
EP-0060437-B1 ELECTROCHEMICAL PROCESS FOR PRODUCING BENZANTHRONES AND PLANAR POLYCYCLIC AROMATIC OXO COMPOUNDS CIBA-GEIGY AG (CH) 1988-08-10 EP claimed
EP-0246193-A2 Process for the preparation of anthraquinoid intermediate products and vat dyes CIBA-GEIGY AG (CH) 1987-11-19 EP claimed
US-4394227-A Electrochemical process for the preparation of benzanthrones and planar, polycyclic aromatic oxygen-containing compounds CIBA-GEIGY AG (CH) 1983-07-19 US claimed
EP-0060437-A1 Electrochemical process for producing benzanthrones and planar polycyclic aromatic oxo compounds CIBA-GEIGY AG (CH) 1982-09-22 EP claimed
EP-0060437-B1 ELECTROCHEMICAL PROCESS FOR PRODUCING BENZANTHRONES AND PLANAR POLYCYCLIC AROMATIC OXO COMPOUNDS CIBA-GEIGY AG (CH) 1988-08-10 EP disclosed
EP-0246193-A2 Process for the preparation of anthraquinoid intermediate products and vat dyes CIBA-GEIGY AG (CH) 1987-11-19 EP disclosed
US-4394227-A Electrochemical process for the preparation of benzanthrones and planar, polycyclic aromatic oxygen-containing compounds CIBA-GEIGY AG (CH) 1983-07-19 US disclosed
EP-0060437-A1 Electrochemical process for producing benzanthrones and planar polycyclic aromatic oxo compounds CIBA-GEIGY AG (CH) 1982-09-22 EP disclosed