SCHEMBL10275250

SCHEMBL10275250

CCc1nn2c(=O)cc(-c3ccc(C(F)(F)F)cc3)[nH]c2c1-c1ccc(Cl)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ARF6 P62330 8/20 0.42
TNKS O95271 1/20 0.37
DPP4 P27487 1/20 0.37
CTSS P25774 3/20 0.36
MARS1 P56192 1/20 0.35
CNR1 P21554 2/20 0.35
CNR2 P34972 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
SCHEMBL10275442 0.87 ARF6 (0.41) ARF6TNKSDPP4MARS1CNR1
SCHEMBL10275395 0.85 ARF6 (0.43) ARF6DPP4MARS1CNR1
SCHEMBL10275550 0.83 ARF6 (0.41) ARF6DPP4CTSSCNR1CNR2
SCHEMBL10276410 0.83 ARF6 (0.42) ARF6TNKSDPP4MARS1CNR1
SCHEMBL10276431 0.80 ARF6 (0.45) ARF6TNKSDPP4MARS1CNR1
SCHEMBL10313835 0.76 ARF6 (0.56) ARF6DPP4
SCHEMBL10275312 0.75 CNR1 (0.41) ARF6CNR1
SCHEMBL10313476 0.75 CRHR1 (0.39) DPP4MARS1
SCHEMBL13516564 0.73 PSD (0.41) ARF6
SCHEMBL10275199 0.73 ARF6 (0.36) ARF6CNR1

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 3355/4885TNKS 2005/4885DPP4 348/4885

“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.