SCHEMBL13814722

SCHEMBL13814722

CCCCCCCCCCCCCCCCCCCCCC(C)C(=O)NC(C)c1ccc(O)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.52
TLR2 O60603 1/20 0.48
MMP2 P08253 2/20 0.46
MMP3 P08254 1/20 0.46
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NPY1R P25929 1/20 0.43
NPY5R Q15761 1/20 0.43
ALDH1A1 P00352 1/20 0.43
ASAH1 Q13510 1/20 0.43
ACER2 Q5QJU3 1/20 0.43
UGCG Q16739 1/20 0.43
HSD17B3 P37058 5/20 0.42
CTDSP1 Q9GZU7 1/20 0.41
MMP9 P14780 1/20 0.41
MMP8 P22894 1/20 0.41
TRPV1 Q8NER1 1/20 0.40

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
SCHEMBL2698951 0.87 POLB (0.69) POLBTLR2MMP2MMP3MEN1
SCHEMBL2698411 0.87 POLB (0.69) POLBTLR2MMP2MMP3MEN1
SCHEMBL13814674 0.83 GAA (0.44) ALDH1A1HSD17B3TRPV1
SCHEMBL24267096 0.78 POLB (0.43) POLBTLR2MMP2MMP3MEN1
SCHEMBL11958347 0.78 UGCG (0.72) MEN1KMT2AALDH1A1ASAH1ACER2
SCHEMBL9000272 0.77 HSD17B3 (0.42) ALDH1A1HSD17B3MMP9TRPV1
Hydroquinone SCHEMBL6913906 0.77 ACE2 (0.62) ALDH1A1HSD17B3TRPV1
SCHEMBL13369040 0.76 NAAA (0.48) ALDH1A1ASAH1ACER2UGCGHSD17B3
SCHEMBL24267092 0.76 POLB (0.40) POLBTLR2MMP2MMP3MEN1
SCHEMBL23171829 0.75 POLB (0.54) POLBMMP2MMP3MEN1KMT2A

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-7553796-B2 Phenol compound, reversible thermosensitive recording medium, reversible thermosensitive recording label, reversible thermosensitive recording member, image-processing apparatus and image-processing method RICOH COMPANY, LTD. (JP) 2009-06-30 US disclosed
US-20080242539-A1 Phenol Compound, Reversible Thermosensitive Recording Medium, Reversible Thermosensitive Recording Label, Reversible Thermosensitive Recording Member, Image-Processing Apparatus and Image-Processing Method RICOH COMPANY, LTD. (JP) 2008-10-02 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-20080242539-A1 Phenol Compound, Reversible Thermosensitive Recording Medium, Reversible Thermosensitive Recording Label, Reversible Thermosensitive Recording Member, Image-Processing Apparatus and Image-Processing Method TRPV1, TRPV6, TRPA1 POLB 3513/4885TLR2 1533/4885MMP2 4220/4885

“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.