SCHEMBL4581918

SCHEMBL4581918

CN(Cc1nc2ccccc2c(=O)n1-c1ccc(F)cc1)C(=O)c1ccc(C(C)(C)C)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 5/20 0.56
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
ALDH1A1 P00352 2/20 0.48
HSD17B10 Q99714 1/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
BLM P54132 1/20 0.46
CXCR3 P49682 3/20 0.46
MAPK1 P28482 2/20 0.44
HTR7 P34969 1/20 0.44
LMNA P02545 1/20 0.44

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
SCHEMBL451679 0.81 ALDH1A1 (0.52) PDE10AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL448957 0.80 CXCR3 (0.57) CXCR3
SCHEMBL451493 0.75 CXCR3 (0.50) CXCR3MAPK1
SCHEMBL1484129 0.73 MEN1 (0.66) PDE10AMEN1KMT2AALDH1A1HSD17B10
SCHEMBL449371 0.73 CXCR3 (0.57) CXCR3
SCHEMBL451318 0.73 CXCR3 (0.49) CXCR3MAPK1
SCHEMBL452387 0.72 HTR7 (0.59) PDE10AMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL452391 0.72 CXCR3 (0.52) PDE10AALDH1A1SMN1; SMN2CXCR3MAPK1
SCHEMBL451143 0.71 CXCR3 (0.51) PDE10AMEN1KMT2AALDH1A1HSD17B10
SCHEMBL453979 0.71 CXCR3 (0.47) MEN1KMT2ACXCR3MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080070864-A1 Quinazolinone Modulators Of Nuclear Receptors X-CEPTOR THERAPEUTICS, INC. (US) 2008-03-20 US 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-20080070864-A1 Quinazolinone Modulators Of Nuclear Receptors NR1H4, NR1H2, NR1H3 PDE10A 1893/4885MEN1 4424/4885KMT2A 3861/4885

“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.