SCHEMBL2806830

SCHEMBL2806830

O=C1Cc2cccc(C(=O)O)c2CO1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.42
HSP90AA1 P07900 2/20 0.40
ALDH1A1 P00352 4/20 0.38
ALOX15 P16050 1/20 0.38
HSD17B10 Q99714 2/20 0.37
PARP1 P09874 2/20 0.36
GAA P10253 1/20 0.35
TYMS P04818 2/20 0.35
TSHR P16473 1/20 0.34
NR4A1 P22736 1/20 0.34
NR4A2 P43354 1/20 0.34
NR4A3 Q92570 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KDM4E B2RXH2 1/20 0.34
CYP1A2 P05177 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34

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
SCHEMBL2808621 0.87 TRPA1 (0.39) TRPA1HSP90AA1ALDH1A1ALOX15HSD17B10
SCHEMBL4915504 0.78 TRPA1 (0.56) TRPA1HSP90AA1ALDH1A1ALOX15HSD17B10
SCHEMBL3884579 0.77 ALDH1A1 (0.44) ALDH1A1ALOX15HSD17B10PARP1TYMS
SCHEMBL21119025 0.75 ALDH1A1 (0.43) TRPA1HSP90AA1ALDH1A1ALOX15HSD17B10
SCHEMBL23630262 0.74 KDM4E (0.37) ALDH1A1HSD17B10TYMSKDM4ECYP1A2
SCHEMBL31718529 0.74 PARP1 (0.39) ALDH1A1HSD17B10PARP1TYMSKDM4E
SCHEMBL5449123 0.74 ALDH1A1 (0.44) HSP90AA1ALDH1A1ALOX15HSD17B10PARP1
SCHEMBL6902823 0.73 TRPA1 (0.55) TRPA1HSP90AA1ALDH1A1ALOX15TSHR
SCHEMBL21818394 0.72 PARP1 (0.45) TRPA1HSP90AA1ALDH1A1ALOX15HSD17B10
SCHEMBL2807475 0.72 AKR1B1 (0.41) TRPA1HSP90AA1ALDH1A1ALOX15PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8968711-B2 Cosmetic or dermatological composition comprising a polymer bearing junction groups, and cosmetic treatment process L'OREAL (FR) 2015-03-03 US claimed
US-20100272660-A1 COSMETIC OR PHARMACEUTICAL COMPOSITION COMPRISING A POLYCONDENSATE, THE SAID POLYCONDENSATE AND METHOD OF COSMETIC TREATMENT L'OREAL (FR) 2010-10-28 US claimed
US-20100239509-A1 COSMETIC OR DERMATOLOGICAL COMPOSITION COMPRISING A POLYMER BEARING JUNCTION GROUPS, AND COSMETIC TREATMENT PROCESS L'OREAL (FR) 2010-09-23 US claimed
US-8968711-B2 Cosmetic or dermatological composition comprising a polymer bearing junction groups, and cosmetic treatment process L'OREAL (FR) 2015-03-03 US disclosed
US-20100272660-A1 COSMETIC OR PHARMACEUTICAL COMPOSITION COMPRISING A POLYCONDENSATE, THE SAID POLYCONDENSATE AND METHOD OF COSMETIC TREATMENT L'OREAL (FR) 2010-10-28 US disclosed
US-20100239509-A1 COSMETIC OR DERMATOLOGICAL COMPOSITION COMPRISING A POLYMER BEARING JUNCTION GROUPS, AND COSMETIC TREATMENT PROCESS L'OREAL (FR) 2010-09-23 US disclosed
US-20090028807-A1 COMPOSITION COMPRISING A POLYCONDENSATE, METHOD OF TREATMENT, POLYCONDENSATE, AND METHOD OF PREPARATION L'OREAL (FR) 2009-01-29 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 (3 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-20100239509-A1 COSMETIC OR DERMATOLOGICAL COMPOSITION COMPRISING A POLYMER BEARING JUNCTION GROUPS, AND COSMETIC TREATMENT PROCESS CUTA, SUCLG1, KRT18 TRPA1 806/4885HSP90AA1 1355/4885ALDH1A1 1901/4885
US-20090028807-A1 COMPOSITION COMPRISING A POLYCONDENSATE, METHOD OF TREATMENT, POLYCONDENSATE, AND METHOD OF PREPARATION CUTA, SYMPK, TPRKB TRPA1 1958/4885HSP90AA1 3043/4885ALDH1A1 4765/4885
US-20100272660-A1 COSMETIC OR PHARMACEUTICAL COMPOSITION COMPRISING A POLYCONDENSATE, THE SAID POLYCONDENSATE AND METHOD OF COSMETIC TREATMENT ACMSD, CUTA, PCCA TRPA1 436/4885HSP90AA1 2665/4885ALDH1A1 1510/4885

“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.