SCHEMBL717885

SCHEMBL717885

CCCCOB(OCCCC)Oc1c(C(C)(C)C)cc(C)cc1C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.35
ALDH1A1 P00352 1/20 0.35
CA2 P00918 1/20 0.35
POLB P06746 1/20 0.35
TYR P14679 1/20 0.35
HSPA5 P11021 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
RXRA P19793 1/20 0.31
PPARG P37231 1/20 0.31

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
SCHEMBL9364029 0.97 CYP3A4 (0.39) CYP3A4CYP2D6SMN1; SMN2ALDH1A1CA2
SCHEMBL7638231 0.83 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1CA2CYP2C9CYP2C19
SCHEMBL11158155 0.80 CYP3A4 (0.32) CYP3A4CYP2D6
SCHEMBL9363723 0.79 SMN1; SMN2 (0.48) CYP3A4CYP2D6SMN1; SMN2ALDH1A1CA2
SCHEMBL29015759 0.78 GAA (0.34)
SCHEMBL10741951 0.74 SMN1; SMN2 (0.34) CYP3A4CYP2D6SMN1; SMN2ALDH1A1CA2
SCHEMBL9662413 0.70 SMN1; SMN2 (0.39) CYP3A4CYP2D6SMN1; SMN2ALDH1A1CA2
SCHEMBL5908087 0.69 RXRA (0.47) CYP3A4CYP2D6SMN1; SMN2ALDH1A1RXRA
SCHEMBL7886624 0.69 SMN1; SMN2 (0.50) CYP3A4CYP2D6SMN1; SMN2ALDH1A1CA2
SCHEMBL2279867 0.68 CYP2D6 (0.38) CYP3A4CYP2D6SMN1; SMN2ALDH1A1CA2

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2429957-B1 TAGGED SCALE INHIBITORS ABSOLUTE PETRO HYDRO TECH CO LTD (CN) 2015-07-29 EP disclosed
EP-2429957-A1 TAGGED SCALE INHIBITORS Absolute Petro Hydro Tech Co. Ltd (CN) 2012-03-21 EP disclosed
US-20120048808-A1 TAGGED SCALE INHIBITORS ABSOLUTE PETRO HYDRO TECH CO. LTD (CN) 2012-03-01 US disclosed
US-7888417-B2 core or the layer includes a composition formed from a base polymer, a crosslink initiator, and at least one additive; additive has at least one carbon-oxygen-boron linkage, carbon in the linkage being a secondary or tertiary carbon; enhances coefficient of restitution and/or reduces compression of core ACUSHNET COMPANY (US) 2011-02-15 US disclosed
WO-2010128322-A1 TAGGED SCALE INHIBITORS ABSOLUTE PETRO HYDRO TECH CO. LTD (CN) 2010-11-11 WO disclosed
US-20080261722-A1 COMPOSITIONS FOR USE IN GOLF BALLS ACUSHNET COMPANY 2008-10-23 US disclosed
US-20080227567-A1 COMPOSITIONS FOR USE IN GOLF BALLS ACUSHNET COMPANY 2008-09-18 US disclosed
US-20080176678-A1 Compositions for Use in Golf Balls ACUSHNET COMPANY 2008-07-24 US disclosed
US-7361711-B2 Compositions for use in golf balls ACUSHNET COMPANY (US) 2008-04-22 US disclosed
US-7358308-B2 Compositions for use in golf balls ACUSHNET COMPANY (US) 2008-04-15 US disclosed
EP-0283252-B1 BLEACHING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1992-10-07 EP disclosed
US-4853143-A PRECURSORS; ANTIOXIDANT-POLYVINYLPYRROLIDONE THE PROCTER & GAMBLE COMPANY (US) 1989-08-01 US disclosed
EP-0320219-A1 Detergent compositions THE PROCTER & GAMBLE COMPANY (US) 1989-06-14 EP disclosed
EP-0283252-A1 Bleaching compositions THE PROCTER & GAMBLE COMPANY (US) 1988-09-21 EP disclosed
US-4507216-A ANTIFRICTION, ANTICORROSION, FUEL CONSUMPTION REDUCING AGENT MOBIL OIL CORPORATION (US) 1985-03-26 US disclosed
US-4392973-A TRANSMISSION FLUIDS THE BRITISH PETROLEUM COMPANY LIMITED (GB) 1983-07-12 US disclosed
EP-0037194-B1 METHOD FOR TRANSMITTING POWER BY TRACTION UTILISING BORATE ESTERS AS TRACTION FLUIDS The British Petroleum Company p.l.c. (GB) 1983-06-08 EP disclosed
EP-0037194-A1 Method for transmitting power by traction utilising borate esters as traction fluids The British Petroleum Company p.l.c. (GB) 1981-10-07 EP disclosed
US-3970620-A Polyvinylchloride compositions for frothing DIAMOND SHAMROCK CORPORATION (US) 1976-07-20 US disclosed
US-3945955-A OPEN-CELLED FOAMS BY MECHANICAL WHIPPING DIAMOND SHAMROCK CORPORATION (US) 1976-03-23 US disclosed