SCHEMBL10276006

SCHEMBL10276006

Cc1nn2c(=O)c(C)c(-c3ccc(C(F)(F)F)cc3)[nH]c2c1-c1ccc(Cl)cc1Cl

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ARF6 P62330 7/20 0.40
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
PLAT P00750 2/20 0.38
HTT P42858 1/20 0.37
CRHR1 P34998 3/20 0.36
PDE2A O00408 1/20 0.36
MARS1 P56192 1/20 0.36
DPP4 P27487 1/20 0.36
HSD11B1 P28845 1/20 0.35

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
SCHEMBL10275550 0.89 ARF6 (0.41) ARF6CNR1CNR2DPP4
SCHEMBL10275490 0.88 ARF6 (0.41) ARF6CNR1CNR2MARS1DPP4
SCHEMBL10275917 0.87 ARF6 (0.50) ARF6CNR1CNR2PLAT
SCHEMBL10275846 0.87 PSD (0.40) ARF6CNR1CNR2PLATHTT
SCHEMBL10275796 0.84 CYP3A4 (0.41) ARF6CNR1CNR2CRHR1DPP4
SCHEMBL10275704 0.84 PDE2A (0.43) PLATPDE2A
SCHEMBL10275273 0.83 PLAT (0.40) ARF6PLATPDE2A
SCHEMBL10275442 0.83 ARF6 (0.41) ARF6CNR1CNR2PLATHTT
SCHEMBL12826214 0.83 CRHR1 (0.37) ARF6CRHR1
SCHEMBL10313459 0.81 PDE2A (0.41) PLATPDE2A

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 3355/4885CNR1 877/4885CNR2 1513/4885

“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.