SCHEMBL7064025

SCHEMBL7064025

C=CC/C(=C\c1ccccc1)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.59
CYP2C9 P11712 1/20 0.59
RECQL P46063 1/20 0.49
AKR1C3 P42330 1/20 0.47
AKR1C1 Q04828 1/20 0.46
MME P08473 2/20 0.42
PAM P19021 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
TP53 P04637 1/20 0.40
HTT P42858 1/20 0.40
OPRK1 P41145 1/20 0.39
ALDH1A1 P00352 3/20 0.38
TSHR P16473 3/20 0.38
GRIK1 P39086 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL1717110 1.00 CYP3A4 (0.59) CYP3A4CYP2C9RECQLAKR1C3AKR1C1
1,6-Hexanediol SCHEMBL31201193 0.86 CYP3A4 (0.46) CYP3A4CYP2C9RECQLAKR1C3AKR1C1
SCHEMBL10972186 0.85 CYP3A4 (0.47) CYP3A4CYP2C9RECQLAKR1C3AKR1C1
SCHEMBL11768715 0.84 CYP3A4 (0.46) CYP3A4CYP2C9RECQLAKR1C3AKR1C1
SCHEMBL10909433 0.82 CYP3A4 (0.61) CYP3A4CYP2C9RECQLAKR1C3AKR1C1
SCHEMBL1363528 0.82 CYP3A4 (0.45) CYP3A4CYP2C9RECQLAKR1C3AKR1C1
SCHEMBL11143424 0.81 CYP3A4 (0.59) CYP3A4CYP2C9RECQLAKR1C3AKR1C1
SCHEMBL10968637 0.81 CYP3A4 (0.42) CYP3A4CYP2C9RECQLAKR1C3AKR1C1
SCHEMBL10972190 0.81 CYP3A4 (0.42) CYP3A4CYP2C9RECQLAKR1C3AKR1C1
SCHEMBL5361947 0.80 SMN1; SMN2 (0.47) CYP3A4CYP2C9HTTALDH1A1GRIK1

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
EP-2197998-B1 PERSONAL CARE COMPOSITIONS COMPRISING DYE-POLYMER COMPLEXES BASF SE (DE) 2012-12-26 EP claimed
EP-2190966-B1 HOME AND FABRIC CARE COMPOSITIONS COMPRISING DYE-POLYMER COMPLEXES BASF SE (DE) 2012-12-26 EP claimed
EP-0898589-B1 RADIATION-CURABLE COMPOSITION HAVING HIGH CURE SPEED DSM IP ASSETS BV (NL) 2004-12-15 EP claimed
US-20020045014-A1 PDLC cell SERBUTOVIEZ CHRISTOPHE (FR) 2002-04-18 US claimed
EP-0889942-B1 PDLC CELL KONINKL PHILIPS ELECTRONICS NV (NL) 2001-10-31 EP claimed
US-6306469-B1 SANDWICHING MIXTURE OF LIQUID CRYSTALLNE MATERIAL, REACTIVE MONOMERS BETWEEN TWO SUBSTRATES, WHICH ARE PROVIDED WITH AN ELECTRODE LAYER, AND POLYMERIZING THE MIXTURE UNDER THE INFLUENCE OF RADIATION U.S. PHILIPS CORPORATION 2001-10-23 US claimed
EP-0889942-A1 PDLC CELL Koninklijke Philips Electronics N.V. (NL) 1999-01-13 EP claimed
WO-1998032814-A1 PDLC CELL KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) 1998-07-30 WO claimed
EP-0898589-B1 RADIATION-CURABLE COMPOSITION HAVING HIGH CURE SPEED DSM IP ASSETS BV (NL) 2004-12-15 EP disclosed
US-6376571-B1 A (ALKYL)PHENYL ACRYLATE DSM N.V. (NL) 2002-04-23 US disclosed
US-20020045014-A1 PDLC cell SERBUTOVIEZ CHRISTOPHE (FR) 2002-04-18 US disclosed
EP-0889942-B1 PDLC CELL KONINKL PHILIPS ELECTRONICS NV (NL) 2001-10-31 EP disclosed
US-6306469-B1 SANDWICHING MIXTURE OF LIQUID CRYSTALLNE MATERIAL, REACTIVE MONOMERS BETWEEN TWO SUBSTRATES, WHICH ARE PROVIDED WITH AN ELECTRODE LAYER, AND POLYMERIZING THE MIXTURE UNDER THE INFLUENCE OF RADIATION U.S. PHILIPS CORPORATION 2001-10-23 US disclosed
EP-0889942-A1 PDLC CELL Koninklijke Philips Electronics N.V. (NL) 1999-01-13 EP disclosed
WO-1998032814-A1 PDLC CELL KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) 1998-07-30 WO disclosed