SCHEMBL15433155

SCHEMBL15433155

CNC(=O)Cc1ccc(CCCCCc2ccccc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 5/20 0.66
GAA P10253 1/20 0.60
HPGD P15428 1/20 0.60
HDAC1 Q13547 5/20 0.56
ALOX5 P09917 1/20 0.56
HDAC2 Q92769 1/20 0.56
SIGMAR1 Q99720 1/20 0.53
MAPT P10636 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
ALDH1A1 P00352 1/20 0.53
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.50

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
SCHEMBL10094805 0.98 TRPV1 (0.63) TRPV1GAAHPGDHDAC1ALOX5
SCHEMBL10094798 0.95 GAA (0.62) TRPV1GAAHPGDHDAC1HDAC2
SCHEMBL60236 0.87 MEN1 (0.65) GAAHPGDMAPTALDH1A1MEN1
SCHEMBL15433150 0.87 TRPV1 (0.54) TRPV1GAAHPGDHDAC1ALOX5
Hydrochloric Acid SCHEMBL6208128 0.85 MEN1 (0.63) GAAHPGDMAPTALDH1A1MEN1
Water SCHEMBL27340800 0.85 MEN1 (0.63) GAAHPGDMAPTALDH1A1MEN1
SCHEMBL11337600 0.85 MEN1 (0.63) GAAHPGDMAPTALDH1A1MEN1
SCHEMBL5990328 0.84 HDAC1 (0.72) HPGDHDAC1ALOX5HDAC2MAPT
SCHEMBL8009605 0.84 HDAC1 (0.72) HPGDHDAC1ALOX5HDAC2MAPT
SCHEMBL16658763 0.84 HDAC1 (0.72) HPGDHDAC1ALOX5HDAC2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140024608-A1 INHIBITORS OF HISTONE DEACETYLASE AND PRODRUGS THEREOF METHYLGENE INC. (CA) 2014-01-23 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-20140024608-A1 INHIBITORS OF HISTONE DEACETYLASE AND PRODRUGS THEREOF HDAC1, HDAC3, HDAC11 TRPV1 3547/4885GAA 182/4885HPGD 348/4885

“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.