SCHEMBL10313602

SCHEMBL10313602

Cc1nn2c(=O)c3ccc(-c4ccc(C#N)cc4)cc3[nH]c2c1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FEN1 P39748 1/20 0.46
TNKS2 Q9H2K2 1/20 0.43
CHEK1 O14757 1/20 0.41
PLAT P00750 1/20 0.40
ARF6 P62330 1/20 0.40
CSF1R P07333 2/20 0.40
SLC11A2 P49281 1/20 0.40
FASN P49327 1/20 0.39
FLT3 P36888 4/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
ATM Q13315 1/20 0.38
MARK3 P27448 1/20 0.37
GSK3A P49840 1/20 0.37
PTGES O14684 1/20 0.37
KDM4E B2RXH2 1/20 0.37
PADI4 Q9UM07 1/20 0.37
BRD4 O60885 1/20 0.37

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
SCHEMBL10313504 0.93 CHEK1 (0.41) FEN1CHEK1PLATARF6SLC11A2
SCHEMBL10275772 0.90 AR (0.43) FEN1TNKS2CHEK1PLATARF6
SCHEMBL10276015 0.88 DGAT1 (0.43) CHEK1PLATARF6FLT3
SCHEMBL10276182 0.84 KMT2A (0.41) CHEK1ARF6FLT3KMT2AKDM4E
SCHEMBL10275539 0.82 FLT3 (0.39) TNKS2CHEK1ARF6FLT3KMT2A
SCHEMBL10313592 0.81 SLC11A2 (0.42) PLATARF6CSF1RSLC11A2KMT2A
SCHEMBL10276044 0.79 PLAT (0.40) FEN1PLATARF6FASNFLT3
SCHEMBL10275606 0.78 CA12 (0.43) FEN1PLATSLC11A2
SCHEMBL10313591 0.78 KDM4E (0.41) PLATARF6CSF1RSLC11A2FASN
SCHEMBL10313518 0.76 CA12 (0.41) PLATPTGES

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 1 patent. 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 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 FEN1 1832/4885TNKS2 2499/4885CHEK1 954/4885

“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.