SCHEMBL4871590

SCHEMBL4871590

CCc1nc2cccnc2n1-c1ccc(-c2nc(-c3nc(C)cs3)cn2-c2ccc(C)nc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
POLB P06746 1/20 0.47
PABPC1 P11940 1/20 0.47
PDE10A Q9Y233 8/20 0.46
TP53 P04637 1/20 0.41
AKT1 P31749 1/20 0.37
PDE4B Q07343 2/20 0.36
CYP2E1 P05181 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2A6 P11509 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2B6 P20813 1/20 0.36
MAPT P10636 1/20 0.34

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
SCHEMBL4810228 0.89 MEN1 (0.47) MEN1KMT2APOLBPABPC1PDE10A
SCHEMBL4876503 0.88 PDE10A (0.45) MEN1KMT2APOLBPABPC1PDE10A
SCHEMBL4878990 0.87 PDE10A (0.48) MEN1KMT2APOLBPABPC1PDE10A
SCHEMBL4855612 0.82 MEN1 (0.39) MEN1KMT2APOLBPABPC1PDE10A
SCHEMBL4807681 0.78 CYP3A4 (0.39) MEN1KMT2APDE10ATP53CYP2E1
SCHEMBL4809409 0.77 PTGS2 (0.36) MEN1KMT2APOLBPABPC1PDE10A
SCHEMBL4869229 0.77 PDE10A (0.45) MEN1KMT2APOLBPABPC1PDE10A
SCHEMBL4869914 0.77 PDE4B (0.35) MEN1KMT2APOLBPABPC1PDE10A
SCHEMBL4869273 0.77 PDE10A (0.47) MEN1KMT2APOLBPABPC1PDE10A
SCHEMBL4874903 0.76 PDE10A (0.37) MEN1KMT2APOLBPABPC1PDE10A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 US claimed
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 US disclosed
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 US disclosed
US-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PFIZER INC 2008-04-17 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-20080090834-A1 SELECTIVE AZOLE PDE10A INHIBITOR COMPOUNDS PDE5A, PDE3B, PDE12 MEN1 913/4885KMT2A 1148/4885POLB 2755/4885

“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.