SCHEMBL15415489

SCHEMBL15415489

COC(=O)C1CCC(N2CCN(c3ccc(Cl)cc3)CC2)C1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.49
GFER P55789 1/20 0.46
MAPT P10636 2/20 0.46
AKR1C3 P42330 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 2/20 0.43
SLC6A2 P23975 6/20 0.43
SLC6A4 P31645 6/20 0.43
SLC6A3 Q01959 6/20 0.43
NOTUM Q6P988 1/20 0.43
DPP4 P27487 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
SCHEMBL16752730 1.00 KMT2A (0.49) KMT2AGFERMAPTAKR1C3SMN1; SMN2
SCHEMBL16769362 0.86 KMT2A (0.52) KMT2AGFERMAPTAKR1C3SMN1; SMN2
SCHEMBL17938065 0.84 AKR1C3 (0.59) KMT2AGFERMAPTAKR1C3SMN1; SMN2
SCHEMBL16752740 0.84 AKR1C3 (0.59) KMT2AGFERMAPTAKR1C3SMN1; SMN2
SCHEMBL25262380 0.81 MAPT (0.66) KMT2AMAPTAKR1C3SMN1; SMN2L3MBTL1
SCHEMBL21339818 0.76 NOTUM (0.68) KMT2AMAPTAKR1C3SMN1; SMN2L3MBTL1
SCHEMBL20840870 0.76 NOTUM (0.68) KMT2AMAPTAKR1C3SMN1; SMN2L3MBTL1
SCHEMBL20840854 0.75 NOTUM (0.54) KMT2AMAPTAKR1C3SMN1; SMN2L3MBTL1
SCHEMBL29284129 0.75 TP53 (0.40) SMN1; SMN2DPP4
SCHEMBL1700363 0.74 TP53 (0.39) SMN1; SMN2L3MBTL1DPP4

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
EP-2870140-B1 TETRAHYDROQUINAZOLINONE DERIVATIVES AS PARP INHIBITORS LUPIN LTD (IN) 2016-07-27 EP disclosed
US-9359367-B2 Tetrahydroquinazolinone derivatives as PARP inhibitors LUPIN LIMITED (IN) 2016-06-07 US disclosed
US-20150152118-A1 Tetrahydroquinazolinone Derivatives as PARP Inhibitors LUPIN LIMITED (IN) 2015-06-04 US disclosed
EP-2870140-A1 TETRAHYDROQUINAZOLINONE DERIVATIVES AS PARP INHIBITORS Lupin Limited (IN) 2015-05-13 EP disclosed
WO-2014009872-A1 TETRAHYDROQUINAZOLINONE DERIVATIVES AS PARP INHIBITORS LUPIN LIMITED (IN) 2014-01-16 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-20150152118-A1 Tetrahydroquinazolinone Derivatives as PARP Inhibitors PARP1, PARP11, PARP3 KMT2A 113/4885GFER 4021/4885MAPT 1178/4885

“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.