SCHEMBL821667

SCHEMBL821667

C=CCC(C=O)Oc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.34
KMT2A Q03164 3/20 0.34
KDM4E B2RXH2 3/20 0.34
MEN1 O00255 2/20 0.34
THRB P10828 1/20 0.34
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
PPARG P37231 3/20 0.33
PPARA Q07869 3/20 0.33
GAA P10253 2/20 0.33
GLA P06280 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
LMNA P02545 1/20 0.32
ALDH1A1 P00352 2/20 0.31
TSHR P16473 1/20 0.31
MAPT P10636 1/20 0.31
ALOX15 P16050 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL7600323 0.85 CYP2C19 (0.39) CYP2C19SMN1; SMN2KMT2AKDM4EMEN1
SCHEMBL6757899 0.81 MTNR1A (0.35) KMT2ATHRBMTNR1AMTNR1BPPARG
SCHEMBL11552062 0.77 CYP2C19 (0.38) CYP2C19SMN1; SMN2KMT2AKDM4EMEN1
SCHEMBL2123805 0.77 MTNR1A (0.39) CYP2C19KMT2AMEN1MTNR1AMTNR1B
SCHEMBL11328284 0.77 MTNR1A (0.39) CYP2C19KMT2AMEN1MTNR1AMTNR1B
SCHEMBL10514058 0.76 CYP2C19 (0.40) CYP2C19SMN1; SMN2KMT2AKDM4EMEN1
SCHEMBL1778182 0.76 CYP2C19 (0.41) CYP2C19SMN1; SMN2KMT2AKDM4EMEN1
SCHEMBL11160064 0.76 PPARG (0.47) PPARGPPARA
SCHEMBL4711438 0.75 CYP2C19 (0.40) CYP2C19SMN1; SMN2KMT2AKDM4EMEN1
SCHEMBL19312195 0.74 CA4 (0.37) KMT2AMEN1MTNR1AMTNR1BPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0633963-B1 SOFT ABSORBENT TISSUE PAPER CONTAINING A BIODEGRADABLE QUATERNIZED AMINE-ESTER SOFTENING COMPOUND AND A TEMPORARY WET STRENGTH RESIN PROCTER & GAMBLE (US) 1997-08-06 EP claimed
EP-0633963-A1 SOFT ABSORBENT TISSUE PAPER CONTAINING A BIODEGRADABLE QUATERNIZED AMINE-ESTER SOFTENING COMPOUND AND A TEMPORARY WET STRENGTH RESIN. PROCTER & GAMBLE (US) 1995-01-18 EP claimed
EP-0598005-A1 AQUEOUS COATING COMPOSITION EASTMAN CHEMICAL COMPANY (US) 1994-05-25 EP claimed
EP-0594691-A1 AQUEOUS COATING COMPOSITION EASTMAN CHEMICAL COMPANY (US) 1994-05-04 EP claimed
WO-1993021383-A1 SOFT ABSORBENT TISSUE PAPER CONTAINING A BIODEGRADABLE QUATERNIZED AMINE-ESTER SOFTENING COMPOUND AND A TEMPORARY WET STRENGTH RESIN THE PROCTER & GAMBLE COMPANY (US) 1993-10-28 WO claimed
WO-1993003085-A1 PROCESS FOR PREPARATION OF AQUEOUS COATING COMPOSITION EASTMAN CHEMICAL COMPANY (US) 1993-02-18 WO claimed
WO-1993003104-A1 AQUEOUS COATING COMPOSITION EASTMAN KODAK COMPANY (US) 1993-02-18 WO claimed
WO-1993001244-A1 AQUEOUS COATING COMPOSITION EASTMAN KODAK COMPANY (US) 1993-01-21 WO claimed
US-4075131-A ANIONIC OR AMPHOTERIC SURFACTANT MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1978-02-21 US claimed
US-11939498-B2 Water borne dry lamination bonding agent with heat resistance improvement DOW GLOBAL TECHNOLOGIES LLC (US) 2024-03-26 US disclosed
US-20240093070-A1 AN ADHESIVE COMPOSITION ROHM AND HAAS COMPANY 2024-03-21 US disclosed
US-20240067845-A1 Waterborne Coating Composition ARKEMA FRANCE (FR) 2024-02-29 US disclosed
EP-3609969-B1 WATER BORNE DRY LAMINATION BONDING AGENT WITH HEAT RESISTANCE IMPROVEMENT DOW GLOBAL TECHNOLOGIES LLC (US) 2023-11-01 EP disclosed
US-20230340311-A1 ADHESIVE COMPOSITION ARKEMA FRANCE (FR) 2023-10-26 US disclosed
US-4092292-A HALOGEN-CONTAINING AMIDE NATIONAL DISTILLERS AND CHEMICAL CORP. (US) 1978-05-30 US disclosed
US-4080246-A PHOSPHORIC ACID, PERCHLORIC COMPOUND, WATER, AND A WETTING AGENT, ETCHING ALUMINUM OR ITS ALLOYS GAF CORPORATION (US) 1978-03-21 US disclosed
US-4075131-A ANIONIC OR AMPHOTERIC SURFACTANT MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1978-02-21 US disclosed
US-4054658-A SEDATIVES, HYPNOSIS WILLIAM H. RORER, INC. (US) 1977-10-18 US disclosed
US-3994715-A ETHYL VANILLIN, ACETOVANILLONE HAWAIIAN SUGAR PLANTERS' ASSOCIATION (US) 1976-11-30 US disclosed
US-3935151-A Blended latex binder for exterior paints with wet primed adhesion BORDEN, INC. (US) 1976-01-27 US disclosed