SCHEMBL678094

SCHEMBL678094

CCCCc1ccc(OCC2CO2)c(OC)c1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 2/20 0.45
DRD4 P21917 3/20 0.44
LYPLA1 O75608 1/20 0.44
LYPLA2 O95372 1/20 0.44
ABHD16A O95870 1/20 0.44
ALDH1A1 P00352 2/20 0.43
GLA P06280 1/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
POLB P06746 1/20 0.43
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ATM Q13315 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL11590752 0.92 NPC1 (0.50) CALM1DRD4ALDH1A1GLANPC1
SCHEMBL22493496 0.88 TNKS2 (0.44) CALM1DRD4ALDH1A1GLAPOLB
SCHEMBL22493504 0.87 HIF1A (0.43) DRD4ALDH1A1GLAMEN1KMT2A
SCHEMBL14141498 0.86 ALDH1A1 (0.47) CALM1DRD4ALDH1A1GLASMN1; SMN2
SCHEMBL9859375 0.83 ALDH1A1 (0.47) DRD4ALDH1A1GLANPC1RAB9A
SCHEMBL21680113 0.82 NPC1 (0.49) DRD4ALDH1A1GLANPC1RAB9A
SCHEMBL21023624 0.81 DRD4 (0.44) CALM1DRD4ALDH1A1GLANPC1
SCHEMBL17857336 0.81 ALDH1A1 (0.46) DRD4ALDH1A1GLANPC1MEN1
SCHEMBL16923005 0.81 DRD4 (0.46) DRD4ALDH1A1GLASMN1; SMN2
SCHEMBL11592596 0.81 DRD4 (0.47) CALM1DRD4ALDH1A1GLAMEN1

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
US-7863399-B2 Curing silicone composition and cured product thereof Dow Corning Toray Company, Ltd (JP) 2011-01-04 US disclosed
US-7863399-B2 Curing silicone composition and cured product thereof Dow Corning Toray Company, Ltd (JP) 2011-01-04 US disclosed
US-7781522-B2 Curable silicone composition and cured product thereof DOW CORNING TORAY COMPANY, LTD. (JP) 2010-08-24 US disclosed
US-7781522-B2 Curable silicone composition and cured product thereof DOW CORNING TORAY COMPANY, LTD. (JP) 2010-08-24 US disclosed
US-20070282058-A1 Curing Silicone Composition and Cured Product Thereof DOW TORAY CO., LTD. (JP) 2007-12-06 US disclosed
US-20070282058-A1 Curing Silicone Composition and Cured Product Thereof DOW TORAY CO., LTD. (JP) 2007-12-06 US disclosed
US-20070225437-A1 Curable Silicone Composition and Cured Product Thereof DOW TORAY CO., LTD. (JP) 2007-09-27 US disclosed
US-20070225437-A1 Curable Silicone Composition and Cured Product Thereof DOW TORAY CO., LTD. (JP) 2007-09-27 US disclosed