SCHEMBL15919261

SCHEMBL15919261

CON(C)C(=O)c1cnccc1NC(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 2/20 0.41
CYP17A1 P05093 4/20 0.40
ATR Q13535 1/20 0.40
ACVR1B P36896 1/20 0.40
TGFBR1 P36897 1/20 0.40
ACVRL1 P37023 1/20 0.40
RAB9A P51151 1/20 0.38
IDO1 P14902 1/20 0.37
BRS3 P32247 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
METAP1 P53582 1/20 0.36
PRMT3 O60678 1/20 0.35
MAPK8 P45983 1/20 0.35
MAPK9 P45984 1/20 0.35
MAPK10 P53779 1/20 0.35

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
SCHEMBL950258 0.83 ATR (0.53) NAMPTCYP17A1ATRACVR1BTGFBR1
SCHEMBL7385007 0.82 RXFP1 (0.49) ATRRAB9AIDO1RXFP1METAP1
SCHEMBL29876641 0.82 RXFP1 (0.49) ATRRAB9AIDO1RXFP1METAP1
SCHEMBL12190376 0.81 NAMPT (0.49) NAMPTCYP17A1ATRACVR1BTGFBR1
SCHEMBL933049 0.81 KDM4C (0.46) NAMPTCYP17A1ATRRAB9AIDO1
SCHEMBL5551442 0.80 SIRT3 (0.47) NAMPTCYP17A1ATRACVR1BTGFBR1
SCHEMBL2210869 0.79 NAMPT (0.47) NAMPTCYP17A1ATRACVR1BTGFBR1
SCHEMBL28764741 0.79 NAMPT (0.44) NAMPTCYP17A1ATRACVR1BTGFBR1
SCHEMBL18522430 0.78 NAMPT (0.50) NAMPTCYP17A1ATRRAB9ABRS3
SCHEMBL31219647 0.77 ATR (0.42) ATRACVR1BTGFBR1ACVRL1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9663488-B2 Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS, INC. (US) 2017-05-30 US disclosed
US-9663488-B2 Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS, INC. (US) 2017-05-30 US disclosed
US-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS Viamet Pharmaceuticals (NC), Inc. 2015-12-10 US disclosed
US-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS Viamet Pharmaceuticals (NC), Inc. 2015-12-10 US disclosed
WO-2014117090-A1 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS, INC. (US) 2014-07-31 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-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS MMEL1, GPX1, MPO NAMPT 481/4885CYP17A1 649/4885ATR 4652/4885

“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.