SCHEMBL5020139

SCHEMBL5020139

CC(C)(NS(=O)(=O)N1CCN(c2ccc(Cl)cc2)CC1)c1cnn[nH]1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.45
MEN1 O00255 4/20 0.44
KMT2A Q03164 4/20 0.44
MMP14 P50281 1/20 0.39
ADAMTS5 Q9UNA0 1/20 0.39
MAPT P10636 3/20 0.39
TP53 P04637 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
LSS P48449 1/20 0.39
DRD4 P21917 4/20 0.38
DRD2 P14416 3/20 0.38
GAA P10253 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
HTR7 P34969 2/20 0.37
HTR6 P50406 2/20 0.37

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
SCHEMBL5020141 0.86 GPR119 (0.41) KMT2ADRD4DRD2L3MBTL1
SCHEMBL5020187 0.80 FPR2 (0.49) MAPTSMN1; SMN2
SCHEMBL4789823 0.78 HSD11B1 (0.47) HSD11B1MEN1KMT2AMMP14ADAMTS5
SCHEMBL5020140 0.78 GRIN2D (0.36) MEN1KMT2AMAPTGAAL3MBTL1
SCHEMBL20997913 0.73 GAA (0.33) MEN1KMT2AMAPTGAASMN1; SMN2
SCHEMBL4757515 0.72 MEN1 (0.51) HSD11B1MEN1KMT2AMMP14ADAMTS5
SCHEMBL5020189 0.72 FPR2 (0.52)
SCHEMBL8109659 0.71 MEN1 (0.52) HSD11B1MEN1KMT2AMMP14ADAMTS5
SCHEMBL4789296 0.66 GPR119 (0.43) MEN1KMT2ADRD4DRD2GAA
SCHEMBL4674022 0.66 MAPT (0.50) HSD11B1MEN1KMT2AMMP14ADAMTS5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3483147-A1 METALLOENZYME INHIBITOR COMPOUNDS Innocrin Pharmaceuticals, Inc. (US) 2019-05-15 EP disclosed
US-20180221364-A1 METALLOENZYME INHIBITOR COMPOUNDS INNOCRIN PHARMACEUTICALS, INC. 2018-08-09 US disclosed
US-20170143694-A1 METALLOENZYME INHIBITOR COMPOUNDS INNOCRIN PHARMACEUTICALS, INC. 2017-05-25 US disclosed
US-20140121248-A1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS, INC. (US) 2014-05-01 US disclosed
US-8623892-B2 Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS, INC. (US) 2014-01-07 US disclosed
US-20130184309-A1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS, INC. (US) 2013-07-18 US disclosed
US-8389543-B2 Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS, INC. (US) 2013-03-05 US disclosed
US-20120129886-A1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS, INC. (US) 2012-05-24 US disclosed
WO-2012064943-A2 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS, INC. (US) 2012-05-18 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 (5 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-20140121248-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GPX1, MPO HSD11B1 823/4885MEN1 511/4885KMT2A 1886/4885
US-20180221364-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GPX1, MPO HSD11B1 823/4885MEN1 511/4885KMT2A 1886/4885
US-20130184309-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GPX1, MPO HSD11B1 823/4885MEN1 511/4885KMT2A 1886/4885
US-20170143694-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GPX1, MPO HSD11B1 823/4885MEN1 511/4885KMT2A 1886/4885
US-20120129886-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GPX1, MPO HSD11B1 823/4885MEN1 511/4885KMT2A 1886/4885

“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.