SCHEMBL5028746

SCHEMBL5028746

CC/C=C(\C)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.42
ATM Q13315 1/20 0.41
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
HSD17B10 Q99714 1/20 0.41
CES2 O00748 2/20 0.40
CES1 P23141 2/20 0.40

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
SCHEMBL1193963 1.00 KDM1A (0.42) KDM1AATMMTNR1AMTNR1BCYP1A2
SCHEMBL2490467 1.00 KDM1A (0.42) KDM1AATMMTNR1AMTNR1BCYP1A2
SCHEMBL30705332 0.83 KDM1A (0.44) KDM1AMTNR1AMTNR1BCYP1A2CYP2D6
SCHEMBL1193728 0.82 CYP1A2 (0.42) KDM1AATMMTNR1AMTNR1BCYP1A2
SCHEMBL10907609 0.82 CYP1A2 (0.42) KDM1AATMMTNR1AMTNR1BCYP1A2
SCHEMBL9757698 0.82 CYP1A2 (0.42) KDM1AATMMTNR1AMTNR1BCYP1A2
SCHEMBL2171728 0.81 KDM1A (0.47) KDM1AMTNR1AMTNR1BCYP1A2CYP2D6
SCHEMBL3588721 0.81 KDM1A (0.47) KDM1AMTNR1AMTNR1BCYP1A2CYP2D6
SCHEMBL2171729 0.81 KDM1A (0.47) KDM1AMTNR1AMTNR1BCYP1A2CYP2D6
SCHEMBL10446347 0.79 ALDH1A1 (0.41) ATMCES2CES1

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022122975-A1 CYCLOPENTENONES DERIVATIVES AND THEIR USE AS ANTIBIOTICS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2022-06-16 WO disclosed
CN-110903172-B Method for stereoselectively synthesizing (E) -tri-substituted olefin 温州大学 2021-08-24 CN disclosed
CN-110903172-A Method for stereoselectively synthesizing (E) -tri-substituted olefin 温州大学 2020-03-24 CN disclosed
US-20150353854-A1 SYNTHESIS OF FUELS AND CHEMICALS FROM SUGARS PIONEER ENERGY INC (US) 2015-12-10 US disclosed
US-20080096787-A1 from waste tires comprising heating tire particles in an enclosures to generate hydrocarbon vapors rich in limonene and naphthalene, and carbon black solids NATURAL RESOURCE RECOVERY, INC. 2008-04-24 US disclosed
WO-2007079133-A2 SYSTEM AND METHOD FOR RECYCLING WASTE INTO ENERGY NATURAL RESOURCE RECOVERY, INC. (US) 2007-07-12 WO disclosed
EP-0975224-A1 PROCESS AND COMPOSITIONS FOR ENHANCING RELIABILITY OF EXOGENOUS CHEMICAL SUBSTANCES APPLIED TO PLANTS MONSANTO COMPANY (US) 2000-02-02 EP disclosed
US-6020287-A USING MIXTURE OF HERBICIDE AND PHENYL-SUBSTITUTED OLEFIN COMPOUND MONSANTO COMPANY (US) 2000-02-01 US disclosed
WO-1998033385-A1 PROCESS AND COMPOSITIONS FOR ENHANCING RELIABILITY OF EXOGENOUS CHEMICAL SUBSTANCES APPLIED TO PLANTS MONSANTO COMPANY (US) 1998-08-06 WO disclosed
US-4967031-A NONCATALYTIC THE UNITED STATES OF AMERICA AS REPRESENTED BY THE UNITED STATES DEPARTMENT OF ENERGY (US) 1990-10-30 US disclosed
US-4868225-A STERICALLY HINDERED META-PHENYLENEDIAMINE CHAIN EXTENDER FOR POLYURETHANES THE DOW CHEMICAL COMPANY (US) 1989-09-19 US disclosed
US-4866208-A CURING AGENT FOR EPOXY RESINS; EXTENDERS FOR POLYUREA-URETHANE COPOLYMERS THE DOW CHEMICAL COMPANY (US) 1989-09-12 US disclosed
US-4792623-A CURING AGENT, EXTENDER THE DOW CHEMICAL COMPANY (US) 1988-12-20 US disclosed
EP-0082258-B1 SUBSTITUTED M-PHENYLENEDIAMINES THE DOW CHEMICAL COMPANY (US) 1986-02-19 EP disclosed
EP-0082258-A1 Substituted m-phenylenediamines THE DOW CHEMICAL COMPANY (US) 1983-06-29 EP disclosed