SCHEMBL4529658

SCHEMBL4529658

CCCCc1ccc(OC(C(=O)NO)c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.47
PTPN1 P18031 1/20 0.47
PPARA Q07869 2/20 0.45
TRPV1 Q8NER1 1/20 0.45
PPARG P37231 1/20 0.45
ALDH1A1 P00352 2/20 0.44
KMT2A Q03164 1/20 0.44
MMP8 P22894 1/20 0.44
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
KDM4A O75164 1/20 0.43
ADRB3 P13945 1/20 0.43

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
SCHEMBL4275342 0.83 PTPN1 (0.64) FFAR1PTPN1PPARAPPARG
SCHEMBL4534563 0.82 GPR88 (0.53) ALDH1A1KMT2AMMP8HPGD
SCHEMBL2844450 0.80 HDAC7 (0.55) ALDH1A1KMT2AMMP8HPGD
SCHEMBL20490353 0.80 HDAC4 (0.62) TRPV1ALDH1A1KMT2AMMP8HPGD
SCHEMBL4538126 0.79 KLK7 (0.53) PPARAPPARGALDH1A1KMT2AHPGD
SCHEMBL5023185 0.78 HDAC7 (0.62) PPARGMMP8
SCHEMBL4536194 0.78 HDAC1 (0.46) KMT2AMMP8HPGD
SCHEMBL2844443 0.78 CYP1A2 (0.50) PTPN1PPARAPPARGALDH1A1
SCHEMBL4534419 0.76 HDAC4 (0.49) PPARAPPARGKMT2A
SCHEMBL4541582 0.76 HDAC4 (0.49) PPARAPPARGALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9096565-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2015-08-04 US disclosed
US-9096565-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2015-08-04 US disclosed
US-9096565-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2015-08-04 US disclosed
US-20090181943-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. (CA) 2009-07-16 US disclosed
US-20090181943-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. (CA) 2009-07-16 US disclosed
US-20090181943-A1 Inhibitors of Histone Deacetylase METHYLGENE INC. (CA) 2009-07-16 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-20090181943-A1 Inhibitors of Histone Deacetylase HDAC1, HDAC11, HDAC3 FFAR1 2662/4885PTPN1 3163/4885PPARA 2222/4885

“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.