SCHEMBL8101445

SCHEMBL8101445

Cc1cc(NC(=O)C(C)(C)C)c2ccccc2n1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.68
KMT2A Q03164 3/20 0.68
MEN1 O00255 2/20 0.68
RAB9A P51151 2/20 0.63
GALR3 O60755 1/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
NPC1 O15118 3/20 0.58
MAPT P10636 2/20 0.58
GUSB P08236 1/20 0.58
OPRK1 P41145 1/20 0.56
IGF1R P08069 2/20 0.56
L3MBTL1 Q9Y468 3/20 0.56
KDM4E B2RXH2 1/20 0.54
CYP2C19 P33261 2/20 0.52
ALDH1A1 P00352 1/20 0.52
GAA P10253 1/20 0.51
POLB P06746 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 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
SCHEMBL4855474 0.84 HTT (0.75) HTTKMT2AMEN1RAB9AGALR3
SCHEMBL5053541 0.83 HTT (0.73) HTTKMT2AMEN1RAB9AGALR3
SCHEMBL4852085 0.83 HTT (0.73) HTTKMT2AMEN1RAB9AGALR3
SCHEMBL3924829 0.82 HTT (0.75) HTTKMT2AMEN1RAB9AGALR3
SCHEMBL6586520 0.79 IGF1R (0.79) HTTKMT2AMEN1RAB9AGALR3
SCHEMBL8402836 0.79 HTT (0.75) HTTKMT2AMEN1RAB9AGALR3
SCHEMBL13609778 0.78 HTT (0.66) HTTKMT2AMEN1RAB9AGALR3
SCHEMBL19308467 0.78 HTT (0.73) HTTKMT2AMEN1RAB9AGALR3
SCHEMBL4872495 0.78 HTT (0.73) HTTKMT2AMEN1RAB9AGALR3
SCHEMBL6586139 0.78 HTT (0.66) HTTKMT2AMEN1RAB9AGALR3

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-20070293530-A1 SULFAMIDE AND SULFAMATE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS METHYLGENE INC. (CA) 2007-12-20 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-20070293530-A1 SULFAMIDE AND SULFAMATE DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS HDAC1, HDAC11, HAT1 HTT 711/4885KMT2A 37/4885MEN1 3832/4885

“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.