SCHEMBL15919394

SCHEMBL15919394

O=C(O)CCCOc1ccc(-c2ccc(-c3cc(N4C(=O)CNC4=O)c4cnccc4n3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.39
PDE3B Q13370 5/20 0.39
PDE3A Q14432 5/20 0.39
P2RY12 Q9H244 3/20 0.39
PDE2A O00408 3/20 0.39
LTB4R Q15722 2/20 0.38
DGAT1 O75907 1/20 0.38
FFAR1 O14842 1/20 0.37
PLA2G2A P14555 2/20 0.37
PDE10A Q9Y233 1/20 0.37
CYP4F2 P78329 4/20 0.36
CYP4A11 Q02928 4/20 0.36
ACACA Q13085 1/20 0.36
XDH P47989 1/20 0.36

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
SCHEMBL15919392 0.92 LTB4R (0.38) FFAR4PDE3BPDE3AP2RY12PDE2A
SCHEMBL15919390 0.91 HDAC1 (0.44)
SCHEMBL15905073 0.91 XDH (0.45) PDE3BPDE3AP2RY12PDE2APLA2G2A
SCHEMBL15905108 0.90 PDE3B (0.42) PDE3BPDE3AP2RY12PLA2G2APDE10A
SCHEMBL18897050 0.84 FFAR4 (0.37) FFAR4PDE3BPDE3AP2RY12PDE2A
SCHEMBL15919391 0.84 HDAC1 (0.44)
SCHEMBL15919358 0.83 XDH (0.43) PDE3BPDE3AP2RY12PDE2APLA2G2A
SCHEMBL15919398 0.83 PDE3B (0.41) PDE3BPDE3AP2RY12PLA2G2APDE10A
Hydrochloric Acid SCHEMBL15905167 0.82 XDH (0.43) PDE3BPDE3AP2RY12PDE2APLA2G2A
SCHEMBL15905376 0.81 MEN1 (0.44) PDE3BPDE3AXDH

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
US-9663488-B2 Metalloenzyme inhibitor compounds VIAMET PHARMACEUTICALS, INC. (US) 2017-05-30 US claimed
US-20150353546-A1 METALLOENZYME INHIBITOR COMPOUNDS Viamet Pharmaceuticals (NC), Inc. 2015-12-10 US claimed
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-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
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 FFAR4 4769/4885PDE3B 2232/4885PDE3A 3019/4885

“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.