SCHEMBL2494629

SCHEMBL2494629

Cc1ccc(NC(=O)c2ccc(N(C)C(N)=O)cc2)c(C(=O)Nc2ccc(Cl)cn2)c1

nearest known ligand 0.81

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 19/20 0.81
KCNH2 Q12809 1/20 0.62
KLKB1 P03952 4/20 0.61
TP53 P04637 1/20 0.58
TSHR P16473 1/20 0.58
NFKB1 P19838 1/20 0.58
RAB9A P51151 1/20 0.58
NFKB2 Q00653 1/20 0.58
RELA Q04206 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58

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
SCHEMBL6107976 0.91 F10 (0.86) F10KCNH2KLKB1TP53TSHR
SCHEMBL2431134 0.90 F10 (1.00) F10KCNH2KLKB1
SCHEMBL12326305 0.90 F10 (0.80) F10KCNH2KLKB1TP53TSHR
SCHEMBL12325912 0.90 F10 (0.86) F10KCNH2KLKB1
SCHEMBL6108061 0.88 F10 (0.77) F10KCNH2KLKB1
SCHEMBL2436470 0.88 F10 (0.77) F10KCNH2KLKB1TP53TSHR
SCHEMBL12326033 0.88 F10 (0.83) F10KCNH2KLKB1
SCHEMBL2431090 0.88 F10 (0.83) F10KCNH2KLKB1
SCHEMBL6111272 0.86 F10 (0.73) F10KCNH2KLKB1
SCHEMBL799840 0.84 F10 (1.00) F10KCNH2

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-9708265-B2 Urethanes, ureas, amidines and related inhibitors of factor Xa PHARMADIALL LIMITED LIABILITY COMPANY (RU) 2017-07-18 US disclosed
EP-2542529-A1 URETHANES, UREAS, AMIDINES AND RELATED INHIBITORS OF FACTOR XA Tovbin, Dmitry Gennadievich (RU) 2013-01-09 EP disclosed
US-20130005778-A1 URETHANES, UREAS, AMIDINES AND RELATED INHIBITORS OF FACTOR XA PHARMADIALL LIMITED LIABILITY COMPANY (RU) 2013-01-03 US disclosed
WO-2011108963-A1 URETHANES, UREAS, AMIDINES AND RELATED INHIBITORS OF FACTOR XA TOVBIN DMITRY GENNADIEVICH (RU) 2011-09-09 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-20130005778-A1 URETHANES, UREAS, AMIDINES AND RELATED INHIBITORS OF FACTOR XA PLAUR, PLAU, UTS2R F10 9/4885KCNH2 1486/4885KLKB1 144/4885

“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.