SCHEMBL3908119

SCHEMBL3908119

OCC(CO)(CSc1ccccc1)CSc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
MAPK1 P28482 1/20 0.48
FFAR1 O14842 1/20 0.45
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
MTNR1A P48039 4/20 0.36
MTNR1B P49286 4/20 0.36
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C19 P33261 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
MAPT P10636 2/20 0.36
HPGD P15428 1/20 0.36
MGLL Q99685 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL13923639 0.78 ANPEP (0.47) ALDH1A1CYP1A2CYP3A4CYP2C19MAPT
SCHEMBL11001602 0.74 FFAR1 (0.47) ALDH1A1MAPK1FFAR1KMT2ANPC1
SCHEMBL1527726 0.73 ALDH1A1 (0.48) ALDH1A1MAPK1FFAR1MEN1KMT2A
SCHEMBL98008 0.73 ALDH1A1 (0.48) ALDH1A1MAPK1FFAR1MEN1KMT2A
SCHEMBL96047 0.72
SCHEMBL10080198 0.71 ALDH1A1 (0.52) ALDH1A1MAPK1FFAR1MAOAMAOB
SCHEMBL779142 0.71 ALDH1A1 (0.52) ALDH1A1MAPK1FFAR1MAOAMAOB
SCHEMBL11131257 0.71 ALDH1A1 (0.52) ALDH1A1MAPK1FFAR1MAOAMAOB
SCHEMBL4984715 0.71 ALDH1A1 (0.52) ALDH1A1MAPK1FFAR1MAOAMAOB
SCHEMBL11642145 0.70 ALDH1A1 (0.50) ALDH1A1MAPK1FFAR1MAOAMAOB

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
EP-1831728-B1 DISPLAYS HAVING A HIGH REFRACTIVE INDEX, DURABLE HARDCOAT LAYER 3M INNOVATIVE PROPERTIES CO (US) 2009-07-29 EP disclosed
US-7491441-B2 High refractive index, durable hard coats 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-02-17 US disclosed
US-7491441-B2 High refractive index, durable hard coats 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-02-17 US disclosed
US-7491441-B2 High refractive index, durable hard coats 3M INNOVATIVE PROPERTIES COMPANY (US) 2009-02-17 US disclosed
EP-1831728-A2 HIGH REFRACTIVE INDEX, DURABLE HARD COATS 3M Innovative Properties Company (US) 2007-09-12 EP disclosed
WO-2006073773-A2 HIGH REFRACTIVE INDEX, DURABLE HARD COATS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-07-13 WO disclosed
US-20060147702-A1 High refractive index, durable hard coats 3M INNOVATIVE PROPERTIES COMPANY 2006-07-06 US disclosed