SCHEMBL2837085

SCHEMBL2837085

COc1ccc(C2CCN(C(C(=O)NO)c3ccccc3)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
HSD11B1 P28845 1/20 0.48
ALDH1A1 P00352 5/20 0.46
MAPT P10636 1/20 0.46
RAB9A P51151 1/20 0.45
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
MAPK1 P28482 1/20 0.44
CYP2C19 P33261 1/20 0.44
TSHR P16473 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
CHRM4 P08173 1/20 0.44
HPGD P15428 1/20 0.44
HIF1A Q16665 1/20 0.44
MMP3 P08254 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
SCHEMBL2842489 0.88 TSHR (0.52) LMNAALDH1A1CYP3A4CYP2C19TSHR
SCHEMBL2848431 0.84 ALDH1A1 (0.47) LMNAALDH1A1MAPTRAB9ACYP3A4
SCHEMBL2838023 0.77 HRH1 (0.51) LMNAALDH1A1CYP3A4CYP2C19TSHR
SCHEMBL27777341 0.76 SMN1; SMN2 (0.61) LMNAL3MBTL1ALDH1A1MAPTRAB9A
SCHEMBL890109 0.74 KCNH2 (0.52) LMNAALDH1A1TSHRMEN1KMT2A
SCHEMBL12175058 0.74 KCNH2 (0.52) LMNAALDH1A1TSHRMEN1KMT2A
SCHEMBL8120069 0.74 TSHR (0.49) LMNAALDH1A1CYP3A4CYP2C19TSHR
SCHEMBL753850 0.74 LMNA (0.63) LMNAL3MBTL1ALDH1A1CYP3A4CYP2C19
SCHEMBL2636579 0.74 HSD11B1 (0.61) LMNAL3MBTL1HSD11B1ALDH1A1MAPT
SCHEMBL8109453 0.73 TSHR (0.45) LMNAALDH1A1CYP3A4CYP2D6CYP2C19

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 10 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
CN-101679220-A Histone deacetylase inhibitor METHYLGENE INC 2010-03-24 CN disclosed
EP-2139850-A1 INHIBITORS OF HISTONE DEACETYLASE Methylgene, Inc. (CA) 2010-01-06 EP 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
WO-2008122115-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2008-10-16 WO disclosed
WO-2008122115-A1 INHIBITORS OF HISTONE DEACETYLASE METHYLGENE INC. (CA) 2008-10-16 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 (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 LMNA 424/4885L3MBTL1 951/4885HSD11B1 147/4885

“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.