SCHEMBL10275539

SCHEMBL10275539

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

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 8/20 0.39
TNKS2 Q9H2K2 1/20 0.38
ARF6 P62330 2/20 0.37
PDE3B Q13370 2/20 0.35
PDE3A Q14432 2/20 0.35
CHEK1 O14757 1/20 0.35
PARP1 P09874 1/20 0.35
PARP2 Q9UGN5 1/20 0.35
ALK Q9UM73 1/20 0.35
KIF11 P52732 1/20 0.34
MIF P14174 1/20 0.34
KMT2A Q03164 1/20 0.34
AR P10275 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
SCHEMBL10275869 0.88 FLT3 (0.38) FLT3TNKS2ARF6PDE3BPDE3A
SCHEMBL10275534 0.88 TNKS2 (0.40) TNKS2ARF6KMT2A
SCHEMBL10276540 0.88 MAPK14 (0.33) FLT3ARF6PARP1PARP2MIF
SCHEMBL10276262 0.87 ARF6 (0.49) FLT3ARF6PDE3BPDE3APARP1
SCHEMBL10276044 0.87 PLAT (0.40) FLT3ARF6KMT2A
SCHEMBL10282686 0.87 FNTA (0.34) FLT3ARF6PARP1PARP2ALK
SCHEMBL10275519 0.86 ARF6 (0.39) TNKS2ARF6PDE3BPDE3A
SCHEMBL10275272 0.86 MEN1 (0.43) TNKS2MIFKMT2A
SCHEMBL10275923 0.86 ARF6 (0.46) FLT3ARF6PDE3BPDE3APARP1
SCHEMBL10282687 0.85 BRD4 (0.43) AR

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 FLT3 780/4885TNKS2 2499/4885ARF6 3355/4885

“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.