SCHEMBL15919448

SCHEMBL15919448

COC(=O)c1cc(-c2ccc(-c3ccc(NS(C)(=O)=O)cc3)cc2)nc2ccncc12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.52
ALDH1A1 P00352 3/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
MAPK10 P53779 3/20 0.51
PLA2G2A P14555 7/20 0.50
MAPT P10636 2/20 0.47
HPGD P15428 2/20 0.47
LMNA P02545 1/20 0.47
HSP90AA1 P07900 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
DHODH Q02127 3/20 0.45
IDO1 P14902 1/20 0.44
TDO2 P48775 1/20 0.44
CYP3A4 P08684 1/20 0.43
PIP4K2A P48426 1/20 0.42
PIP4K2B P78356 1/20 0.42
TP53 P04637 1/20 0.42
GAA P10253 1/20 0.42
TSHR P16473 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
SCHEMBL15905110 0.86 MAPK10 (0.50) KDM4EALDH1A1MEN1KMT2AMAPK10
SCHEMBL15919458 0.85 KMT2A (0.72) KDM4EALDH1A1MEN1KMT2AMAPK10
SCHEMBL15919436 0.83 PLA2G2A (0.50) KDM4EALDH1A1MEN1KMT2APLA2G2A
SCHEMBL15919417 0.83 MEN1 (0.52) KDM4EALDH1A1MEN1KMT2APLA2G2A
SCHEMBL15905538 0.82 PLA2G2A (0.56) KDM4EALDH1A1MEN1KMT2APLA2G2A
SCHEMBL17327507 0.81 PLA2G2A (0.56) KDM4EALDH1A1MEN1KMT2APLA2G2A
SCHEMBL17323662 0.81 PLA2G2A (0.57) KDM4EALDH1A1MEN1KMT2APLA2G2A
SCHEMBL15919477 0.81 ALDH1A1 (0.44) KDM4EALDH1A1MEN1KMT2APLA2G2A
SCHEMBL15919274 0.81 PLA2G2A (0.52) KDM4EALDH1A1MEN1KMT2APLA2G2A
SCHEMBL15905544 0.80 MAPK10 (0.44) KDM4EALDH1A1MEN1KMT2AMAPK10

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 KDM4E 3322/4885ALDH1A1 289/4885MEN1 511/4885

“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.