SCHEMBL4915895

SCHEMBL4915895

C=C(C)CC(C)(N=C=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
HTT P42858 1/20 0.40
CYP2C19 P33261 2/20 0.40
HIF1A Q16665 1/20 0.40
KMT2A Q03164 2/20 0.33
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HDAC3 O15379 1/20 0.32
HDAC4 P56524 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC7 Q8WUI4 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC10 Q969S8 1/20 0.32
HDAC11 Q96DB2 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
ALOX15 P16050 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
SCHEMBL10193743 0.77 CYP2C19 (0.38) ALDH1A1HTTCYP2C19HIF1AKMT2A
SCHEMBL28027917 0.76 CYP2C19 (0.36) ALDH1A1HTTCYP2C19HIF1AKMT2A
SCHEMBL7370956 0.75 ALDH1A1 (0.45) ALDH1A1HTTCYP2C19HIF1AKMT2A
SCHEMBL9292949 0.75 CYP2C19 (0.35) ALDH1A1HTTCYP2C19HIF1AKMT2A
SCHEMBL18091134 0.73 MAPK1 (0.39) ALDH1A1CYP2C19HIF1AKMT2AMAPT
SCHEMBL2068288 0.73 MAPK1 (0.39) ALDH1A1CYP2C19HIF1AKMT2AMAPT
SCHEMBL5892154 0.72 CYP2C19 (0.33) ALDH1A1HTTCYP2C19HIF1AKMT2A
SCHEMBL28864314 0.71 TAAR1 (0.50) ALDH1A1HTTCYP2C19HIF1AKMT2A
SCHEMBL9220144 0.70 TSHR (0.34) KMT2AMAPTTSHRRAB9ANPSR1
SCHEMBL22444493 0.70 KMT2A (0.41) ALDH1A1CYP2C19HIF1AKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080107909-A1 USE OF ANTIADHESIVE PACKAGING MATERIALS FOR PACKAGING CHEMICALS AND FOODSTUFFS BASF AKTIENGESELLSCHAFT (DE) 2008-05-08 US claimed
US-7122599-B2 Coating compositions and polymeric moulding compounds having anti-adhesion and dirt repellency properties BYK-CHEMIE GMBH (DE) 2006-10-17 US claimed
EP-1474491-B1 USE OF ANTI-ADHESIVE PACKAGING MATERIALS FOR PACKAGING CHEMICALS AND FOOD BASF AG (DE) 2006-03-08 EP claimed
US-20050079301-A1 Use of antiadhesive packaging materials for packaging chemicals and foodstuffs BASF AKTIENGESELLSCHAFT (DE) 2005-04-14 US claimed
EP-1193303-B1 Coating composition and polymeric molding materials having anti-adhesive, soil-release properties BYK CHEMIE GMBH (DE) 2005-03-09 EP claimed
EP-1136516-B1 Use of a cross-linkable polymer composition WACKER POLYMER SYSTEMS GMBH (DE) 2005-01-05 EP claimed
EP-1474491-A1 USE OF ANTI-ADHESIVE PACKAGING MATERIALS FOR PACKAGING CHEMICALS AND FOOD BASF AKTIENGESELLSCHAFT (DE) 2004-11-10 EP claimed
WO-2003066763-A1 USE OF ANTI-ADHESIVE PACKAGING MATERIALS FOR PACKAGING CHEMICALS AND FOOD BASF AKTIENGESELLSCHAFT (DE) 2003-08-14 WO claimed
US-20020103288-A1 Coating compostions and polymeric moulding compounds having anti-adhesion and dirt repellency properties BYK-CHEMIE GMBH (DE) 2002-08-01 US claimed
EP-1193303-A2 Coating composition and polymeric molding materials having adhesive, soil-release properties Byk-Chemie GmbH (DE) 2002-04-03 EP claimed
EP-0473900-B1 Isopropenyl-alpha, alpha-dimethylbenzyl isocyanate-grafted polymers CYTEC TECH CORP (US) 2000-02-02 EP claimed
EP-0336129-B1 Room temperature curing, alternating isopropenyldimethylbenzylisocyanate copolymers having high isocyanate fuctionality AMERICAN CYANAMID CO (US) 1994-09-21 EP claimed
EP-0234353-B1 PROCESS FOR THE PRODUCTION OF TETRAMETHYL XYLYLENE DIISOCYANATES AMERICAN CYANAMID COMPANY (US) 1992-04-22 EP claimed
CN-107849358-B Copolymers containing polyether-polysiloxane macromonomer units, process for their preparation and their use in coating compositions and polymer moulding compounds 毕克化学有限公司 2021-05-07 CN disclosed
EP-3344704-B1 COPOLYMERS CONTAINING POLYETHER-POLYSILOXANE MACROMONOMER UNITS, PROCESS OF THEIR PREPARATION AND THEIR USE IN COATING COMPOSITIONS AND POLYMERIC MOULDING COMPOUNDS BYK CHEMIE GMBH (DE) 2019-07-31 EP disclosed
US-10035870-B2 Copolymers containing polyether-polysiloxane macromonomer units, process of their preparation and their use in coating compositions and polymeric moulding compounds BYK-CHEMIE, GMBH (DE) 2018-07-31 US disclosed
EP-1474491-A1 USE OF ANTI-ADHESIVE PACKAGING MATERIALS FOR PACKAGING CHEMICALS AND FOOD BASF AKTIENGESELLSCHAFT (DE) 2004-11-10 EP disclosed
WO-2003066763-A1 USE OF ANTI-ADHESIVE PACKAGING MATERIALS FOR PACKAGING CHEMICALS AND FOOD BASF AKTIENGESELLSCHAFT (DE) 2003-08-14 WO disclosed
US-20020103288-A1 Coating compostions and polymeric moulding compounds having anti-adhesion and dirt repellency properties BYK-CHEMIE GMBH (DE) 2002-08-01 US disclosed
EP-1193303-A2 Coating composition and polymeric molding materials having adhesive, soil-release properties Byk-Chemie GmbH (DE) 2002-04-03 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10035870-B2 Copolymers containing polyether-polysiloxane macromonomer units, process of their preparation and their use in coating compositions and polymeric moulding compounds PUF60, PMM2, MSN ALDH1A1 3432/4885HTT 3907/4885CYP2C19 1146/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.