SCHEMBL335860

SCHEMBL335860

CC(=O)NC(Cc1ccc(C(=O)NC(c2ccccc2)C(O)C(=O)Nc2ccc3nc(N)[nH]c3c2)cc1)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F9 P00740 2/20 0.40
F7 P08709 2/20 0.40
ACP1 P24666 1/20 0.40
GRIN1 Q05586 1/20 0.37
GRIN2B Q13224 1/20 0.37
TYMS P04818 5/20 0.37
ABL1 P00519 1/20 0.36
FABP6 P51161 1/20 0.36
DHFR P00374 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
F11 P03951 1/20 0.36
FPGS Q05932 1/20 0.35
MCHR1 Q99705 2/20 0.34
KDR P35968 1/20 0.34
TEK Q02763 1/20 0.34
PLAU P00749 1/20 0.34
PLAUR Q03405 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
SCHEMBL336039 0.88 DHFR (0.41) F9F7ACP1TYMSABL1
SCHEMBL335501 0.86 NPC1 (0.43) F9F7ACP1TYMSABL1
SCHEMBL335576 0.85 ABL1 (0.43) F9F7ACP1GRIN1GRIN2B
SCHEMBL336014 0.84 ABL1 (0.41) F9F7ACP1GRIN1GRIN2B
SCHEMBL8219489 0.83 F9 (0.43) F9F7ACP1TYMSABL1
SCHEMBL336367 0.83 MAPT (0.47) F9F7ACP1TYMSABL1
SCHEMBL335909 0.83 HDAC3 (0.43) F9F7ABL1FABP6DHFR
SCHEMBL335878 0.83 ABL1 (0.43) F9F7ACP1TYMSABL1
SCHEMBL335948 0.82 ABL1 (0.45) F9F7ACP1ABL1FABP6
SCHEMBL335916 0.82 MTOR (0.46) F9F7ACP1ABL1FABP6

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 F9 3/4885F7 6/4885ACP1 1423/4885

“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.