SCHEMBL2154470

SCHEMBL2154470

OC1CCCCCC(O)C1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.64
LMNA P02545 1/20 0.36
CYP2C9 P11712 1/20 0.36
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
ALDH1A1 P00352 4/20 0.32
HSD17B10 Q99714 1/20 0.32
EPHX1 P07099 5/20 0.30
CYP3A4 P08684 2/20 0.30
NPC1 O15118 2/20 0.30
RAB9A P51151 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
TP53 P04637 1/20 0.30
MAPT P10636 1/20 0.30
KDM4E B2RXH2 1/20 0.30
EPHX2 P34913 1/20 0.30
MGLL Q99685 1/20 0.30

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
SCHEMBL13889159 1.00 TSHR (0.64) TSHRLMNACYP2C9CES2CES1
SCHEMBL15484232 1.00 TSHR (0.64) TSHRLMNACYP2C9CES2CES1
SCHEMBL15484298 1.00 TSHR (0.64) TSHRLMNACYP2C9CES2CES1
SCHEMBL16856533 1.00 TSHR (0.64) TSHRLMNACYP2C9CES2CES1
SCHEMBL15337087 1.00 TSHR (0.64) TSHRLMNACYP2C9CES2CES1
SCHEMBL10795387 1.00 TSHR (0.64) TSHRLMNACYP2C9CES2CES1
SCHEMBL13888941 1.00 TSHR (0.64) TSHRLMNACYP2C9CES2CES1
SCHEMBL13375682 0.96 TSHR (0.60) TSHRLMNACYP2C9CES2CES1
SCHEMBL3089221 0.96
SCHEMBL3089224 0.96

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130085252-A1 POLYCARBONATE AND METHOD OF PREPARING THE SAME CHEIL INDUSTRIES INC. (KR) 2013-04-04 US claimed
US-8410240-B1 Polycarbonate and method of preparing the same CHEIL INDUSTRIES INC. (KR) 2013-04-02 US claimed
US-6686331-B2 PRINCIPAL SOLVENTS, ESPECIALLY MONO AND DIOL PRINCIPAL SOLVENTS, HAVING A SPECIFIED CLOGP VALUE, SPECIFIED TYPES OF SOFTENERS SUCH AS VARISOFT?, WATER AND OPTIONAL ADDITIVES; PREMIX THE PROCTER & GAMBLE COMPANY 2004-02-03 US claimed
US-20030153483-A1 Concentrated, stable fabric softening composition TRINH TOAN (US) 2003-08-14 US claimed
US-20020160926-A1 Concentrated, stable, preferably clear, fabric softening composition TRINH TOAN (US) 2002-10-31 US claimed
US-6395823-B1 MELT MIXING WITH POLYESTER COMPRISING ISOCYANATE REACTIVE GROUP AND REINFORCING FIBER; HEAT RESISTANCE, DUCTILITY, NONHYDROLYZING EASTMAN CHEMICAL COMPANY 2002-05-28 US claimed
US-6369025-B1 USEFUL FOR SOFTENING CLOTH THE PROCTER & GAMBLE COMPANY 2002-04-09 US claimed
US-6323172-B1 AQUEOUS COMPOSITION COMPRISING FABRIC SOFTENER, SELECTED PRINCIPAL SOLVENT, LOW MOLECULAR WEIGHT WATER SOLUBLE SOLVENT TO IMPROVE CLARITY, WATER SOLUBLE CALCIUM AND/OR MAGNESIUM SALT THE PROCTER & GAMBLE COMPANY 2001-11-27 US claimed
EP-1017743-A1 THERMOPLASTIC POLYURETHANE ADDITIVES FOR ENHANCING SOLID STATE POLYMERIZATION RATES EASTMAN CHEMICAL COMPANY (US) 2000-07-12 EP claimed
EP-1017742-A1 THERMOPLASTIC POLYURETHANE ADDITIVES FOR CHAIN EXTENSION AND REACTIVE EXTRUSION EASTMAN CHEMICAL COMPANY (US) 2000-07-12 EP claimed
WO-1999011710-A1 THERMOPLASTIC POLYURETHANE ADDITIVES FOR CHAIN EXTENSION AND REACTIVE EXTRUSION EASTMAN CHEMICAL COMPANY (US) 1999-03-11 WO claimed
WO-1999011711-A1 THERMOPLASTIC POLYURETHANE ADDITIVES FOR ENHANCING SOLID STATE POLYMERIZATION RATES EASTMAN CHEMICAL COMPANY (US) 1999-03-11 WO claimed
EP-0888424-A1 FABRIC SOFTENING COMPOUND/COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1999-01-07 EP claimed
EP-0842250-A1 CONCENTRATED, STABLE FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1998-05-20 EP claimed
EP-0839179-A1 CONCENTRATED, WATER DISPERSIBLE, STABLE, FABRIC SOFTENING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1998-05-06 EP claimed
US-5747443-A BIODEGRADABLE QUATERNARY AMMONIUM COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 1998-05-05 US claimed
WO-1998017756-A1 CONCENTRATED FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1998-04-30 WO claimed
WO-1997034972-A1 FABRIC SOFTENING COMPOUND/COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1997-09-25 WO claimed
WO-1997003170-A1 CONCENTRATED, WATER DISPERSIBLE, STABLE, FABRIC SOFTENING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 1997-01-30 WO claimed
WO-1997003169-A1 CONCENTRATED, STABLE FABRIC SOFTENING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1997-01-30 WO claimed