SCHEMBL15313125

SCHEMBL15313125

COC1=C(O)C=CC(C=CC(=O)NCCc2ccc(O)cc2)C1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.45
TAAR1 Q96RJ0 1/20 0.45
MMP1 P03956 1/20 0.42
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
CNR2 P34972 3/20 0.42
ABCG2 Q9UNQ0 1/20 0.41
KDM4E B2RXH2 1/20 0.41
F13A1 P00488 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
BCHE P06276 1/20 0.40
ACHE P22303 1/20 0.40
ALOX5 P09917 1/20 0.40
CNR1 P21554 1/20 0.40
POLB P06746 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL15313023 0.85 MMP1 (0.46) ALDH1A1TAAR1MMP1MMP2MMP9
SCHEMBL2024880 0.77 CAPN1 (0.44) ALDH1A1MAOB
SCHEMBL2377424 0.77 MMP1 (0.46) ALDH1A1TAAR1MMP1MMP2MMP9
SCHEMBL30932999 0.74 ALDH1A1 (0.33) ALDH1A1KDM4ESMN1; SMN2
Phloretin SCHEMBL2157151 0.73 SLC5A1 (0.46) ALDH1A1KDM4EACHEPOLB
SCHEMBL8269511 0.69 KDM4E (0.62) ALDH1A1TAAR1MMP1MMP2MMP9
SCHEMBL2023203 0.69 AURKA (0.40) ABCG2MAOAMAOB
SCHEMBL14162985 0.69 KDM4E (0.57) ALDH1A1TAAR1MMP1MMP2MMP9
SCHEMBL3396798 0.68 MAOB (0.45) ALDH1A1ABCG2KDM4ESMN1; SMN2BCHE
SCHEMBL10084157 0.68 ALDH1A1 (0.73) ALDH1A1TAAR1MMP1MMP2MMP9

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 2 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

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-20130272983-A1 Para-Coumaric Acid or Para-Hydroxycinnamic Acid Derivatives and their Use in Cosmetic or Dermatological Compositions TYR, CUTA, HPD ALDH1A1 150/4885TAAR1 4832/4885MMP1 546/4885

“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.