SCHEMBL12246750

SCHEMBL12246750

Cc1cc(/C=C/C(=O)NCCc2ccc(OP(=O)(O)O)c(OP(=O)(O)O)c2)ccc1OP(=O)(O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.60
ALDH1A1 P00352 3/20 0.54
KDM4E B2RXH2 2/20 0.54
PKM P14618 1/20 0.54
LMNA P02545 2/20 0.54
HPGD P15428 1/20 0.54
HTT P42858 1/20 0.54
ACHE P22303 2/20 0.53
TYR P14679 1/20 0.53
APP P05067 1/20 0.53
MAOA P21397 1/20 0.51
MAOB P27338 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.49
BCHE P06276 1/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
OPRM1 P35372 1/20 0.48
OPRD1 P41143 1/20 0.48
CNR2 P34972 1/20 0.47
MMP1 P03956 1/20 0.46

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
SCHEMBL12246783 0.96 MAPT (0.56) MAPTALDH1A1KDM4EPKMLMNA
SCHEMBL12299017 0.89 MAPT (0.69) MAPTALDH1A1KDM4EPKMLMNA
SCHEMBL12246751 0.84 MAPT (0.56) MAPTALDH1A1KDM4EPKMLMNA
SCHEMBL12246785 0.83 MAPT (0.55) MAPTALDH1A1KDM4EPKMLMNA
SCHEMBL12246744 0.78 MAPT (0.76) MAPTALDH1A1KDM4EPKMLMNA
SCHEMBL108280 0.78 MAPT (0.60) MAPTALDH1A1KDM4EPKMLMNA
SCHEMBL1917292 0.78 MAPT (0.84) MAPTALDH1A1KDM4EPKMLMNA
SCHEMBL1917252 0.78 MAPT (0.84) MAPTALDH1A1KDM4EPKMLMNA
SCHEMBL32679236 0.78 MAPT (0.84) MAPTALDH1A1KDM4EPKMLMNA
SCHEMBL4812487 0.78 MAPT (0.84) MAPTALDH1A1KDM4EPKMLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9089499-B2 Para-coumaric acid or para-hydroxycinnamic acid derivatives and their use in cosmetic or dermatological compositions UNIVERSITE JOSEPH FOURIER-GRENOBLE 1 (FR) 2015-07-28 US disclosed
US-20130272983-A1 Para-Coumaric Acid or Para-Hydroxycinnamic Acid Derivatives and their Use in Cosmetic or Dermatological Compositions Universite Joseph Fourier-Grenoble 1. (FR) 2013-10-17 US disclosed
US-8481593-B2 Para-coumaric acid or para-hydroxycinnamic acid derivatives and their use in cosmetic or dermatological compositions BASF BEAUTY CARE SOLUTIONS S.A.S. (FR) 2013-07-09 US disclosed
US-20110237551-A1 Para-Coumaric Acid or Para-Hydroxycinnamic Acid Derivatives and Their Use in Cosmetic or Dermatological Compositions BASF BEAUTY CARE SOLUTIONS FRANCE S.A.S. (FR) 2011-09-29 US 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 (2 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-20110237551-A1 Para-Coumaric Acid or Para-Hydroxycinnamic Acid Derivatives and Their Use in Cosmetic or Dermatological Compositions TYR, CUTA, HPD MAPT 3126/4885ALDH1A1 148/4885KDM4E 1240/4885
US-20130272983-A1 Para-Coumaric Acid or Para-Hydroxycinnamic Acid Derivatives and their Use in Cosmetic or Dermatological Compositions TYR, CUTA, HPD MAPT 3115/4885ALDH1A1 150/4885KDM4E 1196/4885

“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.