SCHEMBL2996893

SCHEMBL2996893

CCCCCCCC(=O)c1ccc(C(=O)O)c(O)c1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.60
HSD17B3 P37058 7/20 0.59
HTT P42858 2/20 0.59
FFAR1 O14842 1/20 0.50
PLA2G2A P14555 1/20 0.50
PLA2G5 P39877 1/20 0.50
MEN1 O00255 1/20 0.50
ALDH1A1 P00352 1/20 0.50
MAPT P10636 1/20 0.50
KMT2A Q03164 1/20 0.50
ATM Q13315 1/20 0.50
STS P08842 4/20 0.49
KDM4E B2RXH2 1/20 0.49
KAT8 Q9H7Z6 1/20 0.49

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
SCHEMBL21839460 0.98 HTT (0.60) PPARAHSD17B3HTTFFAR1PLA2G2A
SCHEMBL222170 0.88 KAT8 (0.60) PPARAHSD17B3HTTFFAR1PLA2G2A
SCHEMBL10595067 0.88 KAT8 (0.60) PPARAHSD17B3HTTFFAR1PLA2G2A
SCHEMBL29406518 0.88 KAT8 (0.60) PPARAHSD17B3HTTFFAR1PLA2G2A
SCHEMBL1576935 0.88 KAT8 (0.60) PPARAHSD17B3HTTFFAR1PLA2G2A
SCHEMBL82454 0.88 KAT8 (0.60) PPARAHSD17B3HTTFFAR1PLA2G2A
SCHEMBL220528 0.88 KAT8 (0.60) PPARAHSD17B3HTTFFAR1PLA2G2A
SCHEMBL10594259 0.88 KAT8 (0.60) PPARAHSD17B3HTTFFAR1PLA2G2A
SCHEMBL31751243 0.88 KAT8 (0.60) PPARAHSD17B3HTTFFAR1PLA2G2A
SCHEMBL29623899 0.88 KAT8 (0.60) PPARAHSD17B3HTTFFAR1PLA2G2A

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
US-8609117-B2 Compositions comprising jasmonic acid derivatives and use of the derivatives L'OREAL S.A. (FR) 2013-12-17 US disclosed
US-8603502-B2 Compositions comprising jasmonic acid derivatives and use of these derivatives L'OREAL S.A. (FR) 2013-12-10 US disclosed
US-8481594-B2 Compositions comprising jasmonic acid derivatives and use of these derivatives L'OREAL S. A. (FR) 2013-07-09 US disclosed
US-20120282197-A1 USE OF PIPERIDINE ESTER DERIVATIVE AS SOLVENT IN COSMETIC COMPOSITIONS; COSMETIC COMPOSITIONS COMPRISING IT L'OREAL (FR) 2012-11-08 US disclosed
US-20120282197-A1 USE OF PIPERIDINE ESTER DERIVATIVE AS SOLVENT IN COSMETIC COMPOSITIONS; COSMETIC COMPOSITIONS COMPRISING IT L'OREAL (FR) 2012-11-08 US disclosed
US-20120269746-A1 USE OF CAPROLACTAM DERIVATIVE AS SOLVENT IN COSMETIC COMPOSITIONS; COSMETIC COMPOSITIONS COMPRISING IT L'OREAL (FR) 2012-10-25 US disclosed
US-20120269746-A1 USE OF CAPROLACTAM DERIVATIVE AS SOLVENT IN COSMETIC COMPOSITIONS; COSMETIC COMPOSITIONS COMPRISING IT L'OREAL (FR) 2012-10-25 US disclosed
WO-2011038778-A1 USE OF CAPROLACTAM DERIVATIVE AS SOLVENT IN COSMETIC COMPOSITIONS; COSMETIC COMPOSITIONS COMPRISING IT L'OREAL (FR) 2011-04-07 WO disclosed
WO-2011038776-A1 USE OF PIPERIDINE ESTER DERIVATIVE AS SOLVENT IN COSMETIC COMPOSITIONS; COSMETIC COMPOSITIONS COMPRISING IT L'OREAL (FR) 2011-04-07 WO disclosed
US-20100179222-A1 COMPOSITIONS COMPRISING JASMONIC ACID DERIVATIVES AND USE OF THESE DERIVATIVES L'OREAL S.A. 2010-07-15 US disclosed
US-20100143276-A1 Ester solvents derived from 4-carboxy-2-pyrrolidinone formulated into UV-screening cosmetic compositions L'OREAL (FR) 2010-06-10 US disclosed
US-20100143276-A1 Ester solvents derived from 4-carboxy-2-pyrrolidinone formulated into UV-screening cosmetic compositions L'OREAL (FR) 2010-06-10 US disclosed
EP-2193783-A1 Use of an ester derived from 4-carboxy-2-pyrrolidinone as a solvent in cosmetic compositions; cosmetic compositions containing same L'Oreal (FR) 2010-06-09 EP disclosed
US-20100069497-A1 COMPOSITIONS COMPRISING JASMONIC ACID DERIVATIVES AND USE OF THESE DERIVATIVES L'OREAL 2010-03-18 US disclosed
US-20040029839-A1 Compositions comprising jasmonic acid derivatives and use of these derivatives L'OREAL S.A. (FR) 2004-02-12 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 (6 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-20100069497-A1 COMPOSITIONS COMPRISING JASMONIC ACID DERIVATIVES AND USE OF THESE DERIVATIVES CBR1, CBR3, DECR1 PPARA 279/4885HSD17B3 260/4885HTT 3268/4885
US-20040029839-A1 Compositions comprising jasmonic acid derivatives and use of these derivatives CBR1, CBR3, DECR1 PPARA 343/4885HSD17B3 160/4885HTT 2239/4885
US-20100179222-A1 COMPOSITIONS COMPRISING JASMONIC ACID DERIVATIVES AND USE OF THESE DERIVATIVES CBR1, CBR3, DECR1 PPARA 242/4885HSD17B3 251/4885HTT 3246/4885
US-20120282197-A1 USE OF PIPERIDINE ESTER DERIVATIVE AS SOLVENT IN COSMETIC COMPOSITIONS; COSMETIC COMPOSITIONS COMPRISING IT PLD1, PLD2, FFAR1 PPARA 157/4885HSD17B3 517/4885HTT 3363/4885
US-20120269746-A1 USE OF CAPROLACTAM DERIVATIVE AS SOLVENT IN COSMETIC COMPOSITIONS; COSMETIC COMPOSITIONS COMPRISING IT DEGS1, CAPN1, PPT1 PPARA 691/4885HSD17B3 570/4885HTT 3226/4885
US-20100143276-A1 Ester solvents derived from 4-carboxy-2-pyrrolidinone formulated into UV-screening cosmetic compositions FASN, ALOX12, PAH PPARA 70/4885HSD17B3 624/4885HTT 3261/4885

“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.