SCHEMBL335373

SCHEMBL335373

CCSc1ccc(C(=O)NC(c2ccccc2)C(O)C(=O)Nc2ccc3nc(N)[nH]c3c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TYMS P04818 11/20 0.43
DHFR P00374 2/20 0.41
ABL1 P00519 1/20 0.40
FABP6 P51161 1/20 0.40
FPGS Q05932 1/20 0.40
F7 P08709 2/20 0.40
F9 P00740 1/20 0.40
ACP1 P24666 1/20 0.38
MAPT P10636 1/20 0.38
MAPK1 P28482 1/20 0.38
F3 P13726 1/20 0.38

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
SCHEMBL336448 0.91 TYMS (0.45) TYMSDHFRABL1FABP6FPGS
SCHEMBL335501 0.89 NPC1 (0.43) TYMSDHFRABL1FABP6F7
SCHEMBL336367 0.88 MAPT (0.47) TYMSDHFRABL1FABP6F7
SCHEMBL336014 0.88 ABL1 (0.41) TYMSDHFRABL1FABP6F7
SCHEMBL335878 0.87 ABL1 (0.43) TYMSABL1FABP6F7F9
SCHEMBL335948 0.87 ABL1 (0.45) ABL1FABP6F7F9ACP1
SCHEMBL335396 0.87 F7 (0.44) DHFRF7F9MAPTF3
SCHEMBL335484 0.87 MAPT (0.43) TYMSABL1FABP6F7F9
SCHEMBL335376 0.87 PDE2A (0.45) TYMSABL1FABP6F7F9
SCHEMBL335576 0.86 ABL1 (0.43) TYMSDHFRABL1FABP6F7

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
EP-2069289-B1 ISOSERINE DERIVATIVES FOR USE AS COAGULATION FACTOR IXa INHIBITORS SANOFI SA (FR) 2013-10-02 EP claimed
US-8097758-B2 Isoserine derivatives for use as coagulation factor IXa inhibitors SANOFI-AVENTIS (FR) 2012-01-17 US claimed
US-20090233949-A1 ISOSERINE DERIVATIVES FOR USE AS COAGULATION FACTOR IXA INHIBITORS SANOFI-AVENTIS (FR) 2009-09-17 US claimed
EP-2069289-B1 ISOSERINE DERIVATIVES FOR USE AS COAGULATION FACTOR IXa INHIBITORS SANOFI SA (FR) 2013-10-02 EP 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-20090233949-A1 ISOSERINE DERIVATIVES FOR USE AS COAGULATION FACTOR IXA INHIBITORS TFPI, F2, F9 TYMS 1838/4885DHFR 430/4885ABL1 2660/4885

“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.