SCHEMBL629974

SCHEMBL629974

CCc1cc(C)ccc1/C=C/C=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 4/20 0.40
CCND1 P24385 4/20 0.40
SRC P12931 2/20 0.38
PDE5A O76074 1/20 0.34
ALDH1A1 P00352 3/20 0.33
CCNB2 O95067 2/20 0.33
CDK1 P06493 2/20 0.33
CCNB1 P14635 2/20 0.33
CCNB3 Q8WWL7 2/20 0.33
MAPT P10636 2/20 0.33
RXFP1 Q9HBX9 1/20 0.33
MAPK1 P28482 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
KDM4E B2RXH2 2/20 0.33
TRPA1 O75762 2/20 0.32
TAAR1 Q96RJ0 1/20 0.32

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
SCHEMBL629975 1.00 CDK4 (0.40) CDK4CCND1SRCPDE5AALDH1A1
SCHEMBL29276388 0.84 PDE5A (0.38) CDK4CCND1SRCPDE5AALDH1A1
SCHEMBL17749456 0.83 CDK4 (0.36) CDK4CCND1SRCALDH1A1CCNB2
SCHEMBL17749102 0.83 CDK4 (0.36) CDK4CCND1SRCALDH1A1CCNB2
SCHEMBL29276389 0.82 PDE5A (0.37) SRCPDE5AALDH1A1MAPTPTGS2
SCHEMBL14679790 0.82 SRC (0.36) CDK4CCND1SRCPDE5ACCNB2
SCHEMBL606252 0.80 SRC (0.50) SRCALDH1A1MAPTRXFP1L3MBTL1
SCHEMBL3629587 0.79 CYP1A1 (0.43) CDK4CCND1ALDH1A1MAPTMAPK1
SCHEMBL14674514 0.79 CYP1A1 (0.43) CDK4CCND1ALDH1A1MAPTMAPK1
SCHEMBL12402952 0.76 GABRA1 (0.45) CDK4CCND1ALDH1A1CCNB2CDK1

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-20230120003-A1 Methods for Stimulating a Hydrocarbon-bearing Formation by Perforating a Wellbore and Introducing an Acidic Composition in the Wellbore HSBC BANK MIDDLE EAST LIMITED (AE) 2023-04-20 US claimed
WO-2016190865-A1 CORROSION INHIBITION OF HCL TREATMENT FLUIDS WITH ENVIRONMENTALLY COMPATIBLE SOLVENT HALLIBURTON ENERGY SERVICES, INC. (US) 2016-12-01 WO claimed
EP-2419549-A1 CORROSION INHIBITOR COMPOSITIONS COMPRISING THE REACTION PRODUCT FORMED FROM AN ALDEHYDE WITH A THIOL AND/OR AN AMINE FUNCTIONALIZED RING STRUCTURE AND ASSOCIATED METHODS Halliburton Energy Services, Inc. (US) 2012-02-22 EP claimed
WO-2010119235-A1 CORROSION INHIBITOR COMPOSITIONS COMPRISING THE REACTION PRODUCT FORMED FROM AN ALDEHYDE WITH A THIOL AND/OR AN AMINE FUNCTIONALIZED RING STRUCTURE AND ASSOCIATED METHODS HALLIBURTON ENERGY SERVICES, INC. (US) 2010-10-21 WO claimed
US-20230120003-A1 Methods for Stimulating a Hydrocarbon-bearing Formation by Perforating a Wellbore and Introducing an Acidic Composition in the Wellbore HSBC BANK MIDDLE EAST LIMITED (AE) 2023-04-20 US disclosed
WO-2016190865-A1 CORROSION INHIBITION OF HCL TREATMENT FLUIDS WITH ENVIRONMENTALLY COMPATIBLE SOLVENT HALLIBURTON ENERGY SERVICES, INC. (US) 2016-12-01 WO disclosed
EP-1689911-A1 METHODS AND COMPOSITIONS FOR INHIBITING METAL CORROSION Halliburton Energy Services, Inc. (US) 2006-08-16 EP disclosed
WO-2005054544-A1 METHODS AND COMPOSITIONS FOR INHIBITING METAL CORROSION HALLIBURTON ENERGY SERVICES, INC. (US) 2005-06-16 WO disclosed