SCHEMBL10275511

SCHEMBL10275511

Cc1c(-c2ccc(C#N)cc2)[nH]c2c(-c3ccc(Cl)cc3Cl)c(O)nn2c1=O

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ARF6 P62330 7/20 0.43
KDM4E B2RXH2 1/20 0.40
KMT2A Q03164 2/20 0.39
CYP3A4 P08684 1/20 0.38
DPP4 P27487 1/20 0.38
DPP8 Q6V1X1 1/20 0.38
DPP9 Q86TI2 1/20 0.38
CNR1 P21554 4/20 0.35
CNR2 P34972 2/20 0.35
MAP2 P11137 1/20 0.35
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
GSK3B P49841 2/20 0.34
GSK3A P49840 1/20 0.34
DYRK1A Q13627 1/20 0.34
CLK4 Q9HAZ1 1/20 0.34
MAPT P10636 1/20 0.33

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
SCHEMBL10275796 0.90 CYP3A4 (0.41) ARF6KDM4EKMT2ACYP3A4DPP4
SCHEMBL10276119 0.87 ARF6 (0.42) ARF6KDM4EKMT2ACYP3A4DPP4
SCHEMBL10276039 0.86 ARF6 (0.41) ARF6KDM4EKMT2ACYP3A4DPP4
SCHEMBL10275540 0.85 ARF6 (0.51) ARF6KDM4EKMT2ACYP3A4DPP4
SCHEMBL10313481 0.82 ARF6 (0.41) ARF6KDM4EKMT2ACYP3A4DPP4
SCHEMBL10275181 0.81 MEN1 (0.38) ARF6KMT2ACYP3A4DPP4DPP8
SCHEMBL10275435 0.79 ALDH1A1 (0.42) ARF6KDM4EKMT2ACYP3A4DPP4
SCHEMBL10276182 0.76 KMT2A (0.41) ARF6KDM4EKMT2ACYP3A4DPP4
SCHEMBL10276006 0.75 ARF6 (0.40) ARF6DPP4CNR1CNR2
SCHEMBL10275893 0.74 CYP3A4 (0.41) ARF6KDM4EKMT2ACYP3A4DPP4

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-20120178915-A1 PYRIMIDINE DERIVATIVES AND ANALOGS, PREPARATION METHOD AND USE THEREOF XU LIFENG (US) 2012-07-12 US claimed
US-20120178915-A1 PYRIMIDINE DERIVATIVES AND ANALOGS, PREPARATION METHOD AND USE THEREOF XU LIFENG (US) 2012-07-12 US disclosed
US-20120178915-A1 PYRIMIDINE DERIVATIVES AND ANALOGS, PREPARATION METHOD AND USE THEREOF XU LIFENG (US) 2012-07-12 US disclosed
WO-2011035518-A1 PYRIMIDINE DERIVATIVES AND ANALOGS, PREPARATION METHOD AND USE THEREOF 辽宁利锋科技开发有限公司 (CN) 2011-03-31 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-20120178915-A1 PYRIMIDINE DERIVATIVES AND ANALOGS, PREPARATION METHOD AND USE THEREOF TYMP, TYMS, ADORA3 ARF6 3355/4885KDM4E 3483/4885KMT2A 4649/4885

“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.