SCHEMBL210490

SCHEMBL210490

COC(=O)c1ccc(Cc2nc3cc(Cl)c(F)cc3[nH]2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHEB Q15382 1/20 0.54
MAPT P10636 3/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
MAPK1 P28482 1/20 0.51
PKM P14618 2/20 0.44
GAA P10253 2/20 0.44
F10 P00742 2/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.43
MEN1 O00255 1/20 0.43
CASP3 P42574 1/20 0.43
KMT2A Q03164 1/20 0.43
SENP7 Q9BQF6 1/20 0.43
CNR2 P34972 1/20 0.43
HSD17B10 Q99714 1/20 0.43
AR P10275 1/20 0.43
CACNA1B Q00975 1/20 0.43
PDE10A Q9Y233 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL4565565 0.81 MAPT (0.48) RHEBMAPTSMN1; SMN2MAPK1PKM
SCHEMBL212718 0.79 HDAC1 (0.51)
SCHEMBL23280103 0.78 SMN1; SMN2 (0.50) MAPTSMN1; SMN2MAPK1PKMGAA
SCHEMBL212212 0.78 MAPT (0.56) RHEBMAPTSMN1; SMN2GAAALDH1A1
SCHEMBL2878961 0.77 HSD17B10 (0.66) MAPTSMN1; SMN2MAPK1PKMGAA
SCHEMBL23280119 0.76 ALDH1A1 (0.47) RHEBMAPTSMN1; SMN2MAPK1PKM
SCHEMBL23280046 0.76 ALDH1A1 (0.50) MAPTSMN1; SMN2MAPK1PKMHSD17B10
SCHEMBL13991772 0.75 SMN1; SMN2 (0.56) MAPTSMN1; SMN2MAPK1PKMGAA
SCHEMBL23280169 0.74 KIF11 (0.50) MAPTSMN1; SMN2MAPK1PKMGAA
SCHEMBL30956291 0.74 CACNA1B (0.49) MAPTSMN1; SMN2PKMGAAF10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8088805-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2012-01-03 US disclosed
US-8088805-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2012-01-03 US disclosed
US-8088805-B2 Inhibitors of histone deacetylase METHYLGENE INC. (CA) 2012-01-03 US disclosed
US-20070213330-A1 Anticancer agents; antiproliferative agents METHYLGENE INC. (CA) 2007-09-13 US disclosed
US-20070213330-A1 Anticancer agents; antiproliferative agents METHYLGENE INC. (CA) 2007-09-13 US disclosed
US-20070213330-A1 Anticancer agents; antiproliferative agents METHYLGENE INC. (CA) 2007-09-13 US disclosed
US-7253204-B2 Antiproliferative agents METHYLGENE INC. (CA) 2007-08-07 US disclosed
US-7253204-B2 Antiproliferative agents METHYLGENE INC. (CA) 2007-08-07 US disclosed
US-7253204-B2 Antiproliferative agents METHYLGENE INC. (CA) 2007-08-07 US disclosed
EP-1735319-A1 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2006-12-27 EP disclosed
US-20050245518-A1 Antiproliferative agents METHYLGENE, INC. 2005-11-03 US disclosed
WO-2005092899-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2005-10-06 WO disclosed
WO-2005092899-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2005-10-06 WO 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 (2 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-20070213330-A1 Anticancer agents; antiproliferative agents HDAC1, HDAC11, HDAC5 RHEB 1082/4885MAPT 3612/4885SMN1; SMN2 3557/4885
US-20050245518-A1 Antiproliferative agents HDAC1, HDAC11, HDAC5 RHEB 986/4885MAPT 3905/4885SMN1; SMN2 2705/4885

“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.