SCHEMBL10275519

SCHEMBL10275519

Cc1nn2c(=O)c3ccc(-c4ccc(C(F)(F)F)cc4)cc3[nH]c2c1-c1ccc(F)cc1F

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ARF6 P62330 3/20 0.39
PLAT P00750 2/20 0.38
TNKS2 Q9H2K2 2/20 0.38
TRPV1 Q8NER1 3/20 0.38
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
MAPT P10636 1/20 0.36
PDE2A O00408 1/20 0.35
PGR P06401 1/20 0.35
NR3C2 P08235 1/20 0.35
FEN1 P39748 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34
MCHR1 Q99705 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
SCHEMBL10313546 0.93 ARF6 (0.41) ARF6PLATTNKS2TRPV1CA12
SCHEMBL10275534 0.89 TNKS2 (0.40) ARF6PLATTNKS2PGRNR3C2
SCHEMBL10276415 0.88 ARF6 (0.38) ARF6TNKS2TRPV1CA12CA9
SCHEMBL10276150 0.87 KDM4E (0.42) ARF6PLATTNKS2TRPV1MAPT
SCHEMBL10275606 0.87 CA12 (0.43) PLATTRPV1CA12CA9MAPT
SCHEMBL10275272 0.87 MEN1 (0.43) TNKS2MAPT
SCHEMBL10275539 0.86 FLT3 (0.39) ARF6TNKS2PDE3BPDE3A
SCHEMBL10313518 0.84 CA12 (0.41) PLATTRPV1CA12CA9MAPT
SCHEMBL10275273 0.83 PLAT (0.40) ARF6PLATMAPTPDE2APGR
SCHEMBL10276351 0.81 TRPV1 (0.37) ARF6TNKS2TRPV1CA12CA9

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 3355/4885PLAT 2180/4885TNKS2 2499/4885

“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.