SCHEMBL14629940

SCHEMBL14629940

COc1cc(CI)cc(C(=O)Nc2ccc(CI)cc2)c1NC(=O)c1ccc(C(=N)N(C)C)cc1F

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 7/20 0.43
KCNH2 Q12809 3/20 0.42
KLK1 P06870 2/20 0.39
KLK5 Q9Y337 2/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPK1 P28482 1/20 0.39
HSD17B10 Q99714 1/20 0.39
POLB P06746 2/20 0.37
HDAC8 Q9BY41 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
KDM4E B2RXH2 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
PPARA Q07869 1/20 0.36
NPC1 O15118 1/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL14629932 0.90 F10 (0.53) F10KCNH2KLK1KLK5MAPT
SCHEMBL14632263 0.87 F10 (0.56) F10KCNH2
SCHEMBL14629928 0.84 KCNH2 (0.48) F10KCNH2KLK1KLK5MAPT
SCHEMBL14629927 0.84 KCNH2 (0.47) KCNH2MAPTMEN1KMT2ANPC1
SCHEMBL14366485 0.83 F10 (0.52) F10KLK1KLK5MAPTALDH1A1
SCHEMBL14629941 0.83 F10 (0.55) F10KCNH2L3MBTL1
SCHEMBL10179258 0.83 F10 (0.63) F10KCNH2ALDH1A1POLBHDAC8
SCHEMBL14345305 0.78 F10 (0.56) F10KCNH2MAPTALDH1A1POLB
SCHEMBL14632265 0.77 F10 (0.68) F10KCNH2
SCHEMBL14345457 0.76 F10 (0.49) F10KCNH2KLK1KLK5MAPT

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-20070021472-A1 N-(5-bromo-2-pyridinyl)-(2-4-[(2-aminosulfonyl)phenyl]phenylcarbonylamino)phenylcarboxamide; potent and highly selective inhibitors; coagulation disorders; antithrombotic agents; diagnostic reagents; good bioavailability and/or solubility MILLENNIUM PHARMACEUTICALS, INC. 2007-01-25 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-20070021472-A1 N-(5-bromo-2-pyridinyl)-(2-4-[(2-aminosulfonyl)phenyl]phenylcarbonylamino)phenylcarboxamide; potent and highly selective inhibitors; coagulation disorders; antithrombotic agents; diagnostic reagents; good bioavailability and/or solubility F2, TFPI, PLG F10 18/4885KCNH2 1101/4885KLK1 1344/4885

“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.