SCHEMBL2312917

SCHEMBL2312917

O=c1c2ccccc2sc2cc(CCO)cc(CCO)c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 9/20 0.50
MAOB P27338 9/20 0.50
MAPT P10636 5/20 0.47
ALDH1A1 P00352 4/20 0.47
POLB P06746 3/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
GAA P10253 1/20 0.47
KDM4E B2RXH2 2/20 0.40
RAB9A P51151 3/20 0.38
CYP1A2 P05177 3/20 0.38
CYP3A4 P08684 3/20 0.38
NPC1 O15118 2/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
LMNA P02545 2/20 0.37
CYP2D6 P10635 2/20 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
SCHEMBL18243450 0.83 MAPT (0.47) MAOAMAOBMAPTALDH1A1POLB
SCHEMBL2312878 0.82 MAOA (0.48) MAOAMAOBMAPTALDH1A1POLB
SCHEMBL18242716 0.81 MAPT (0.45) MAOAMAOBMAPTALDH1A1POLB
SCHEMBL2308573 0.81 MAPT (0.48) MAOAMAOBMAPTALDH1A1POLB
SCHEMBL2309971 0.80 KDM4E (0.47) MAOAMAOBMAPTALDH1A1POLB
SCHEMBL12284413 0.80 MAOA (0.51) MAOAMAOBMAPTALDH1A1POLB
SCHEMBL2310251 0.80 MAOA (0.37) MAOAMAOBMAPTALDH1A1POLB
SCHEMBL2307733 0.77 MAOA (0.40) MAOAMAOBMAPTALDH1A1POLB
SCHEMBL2311180 0.77 KDM4E (0.51) MAOAMAOBMAPTALDH1A1POLB
SCHEMBL2307395 0.77 KDM4E (0.55) MAOAMAOBMAPTALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7989517-B2 Actinic ray curable composition, actinic ray curable ink, and image formation process employing the same KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2011-08-02 US disclosed
US-20070123600-A1 ACTINIC RAY CURABLE COMPOSITION, ACTINIC RAY CURABLE INK, AND IMAGE FORMATION PROCESS EMPLOYING THE SAME KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-05-31 US disclosed