SCHEMBL4566801

SCHEMBL4566801

CC(=O)N(c1ccccc1)C(C(N)=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 15/20 0.53
NR1I2 O75469 2/20 0.45
ALOX5 P09917 1/20 0.42
LMNA P02545 2/20 0.40
ALDH1A1 P00352 1/20 0.40
TP53 P04637 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPT P10636 1/20 0.39
APAF1 O14727 1/20 0.39
NPC1 O15118 1/20 0.39
EPHX1 P07099 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
SCHEMBL7093909 0.80 TRPM8 (0.51) TRPM8NR1I2ALOX5LMNASMN1; SMN2
SCHEMBL8802828 0.79 ALDH1A1 (0.46) TRPM8ALOX5LMNAALDH1A1TP53
SCHEMBL10974191 0.77 TRPM8 (0.50) TRPM8NR1I2ALOX5EPHX1
SCHEMBL28133348 0.77 CES2 (0.45) ALOX5LMNAALDH1A1TP53SMN1; SMN2
SCHEMBL18867910 0.77 LMNA (0.51) TRPM8ALOX5LMNAALDH1A1TP53
SCHEMBL4152158 0.76 TRPM8 (0.56) TRPM8NR1I2ALOX5ALDH1A1EPHX1
SCHEMBL5801209 0.76 TRPM8 (0.47) TRPM8NR1I2ALOX5ALDH1A1SMN1; SMN2
SCHEMBL7560686 0.75 ALOX5 (0.44) TRPM8NR1I2ALOX5LMNAALDH1A1
SCHEMBL6358138 0.74 TRPM8 (0.51) TRPM8NR1I2ALDH1A1SMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL7757903 0.74 TRPM8 (0.54) TRPM8NR1I2ALOX5ALDH1A1EPHX1

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-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

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 TRPM8 4155/4885NR1I2 291/4885ALOX5 2866/4885

“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.