SCHEMBL2433423

SCHEMBL2433423

COc1ccc(NC(=O)c2ccc(C)cc2NC(=O)C(F)(F)F)c(C(=O)Nc2ccc(Cl)cn2)c1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F10 P00742 16/20 0.58
KCNH2 Q12809 5/20 0.58
F2 P00734 2/20 0.58
NPC1 O15118 2/20 0.51
RAB9A P51151 2/20 0.51
MITF O75030 1/20 0.51
TP53 P04637 1/20 0.51
GAA P10253 1/20 0.51
F9 P00740 1/20 0.51
PRSS1 P07477 1/20 0.51
PRSS2 P07478 1/20 0.51
F7 P08709 1/20 0.51
PRSS3 P35030 1/20 0.51
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47

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
SCHEMBL2436471 0.92 F10 (0.60) F10KCNH2RAB9ATP53
SCHEMBL2436337 0.91 F10 (0.56) F10KCNH2
SCHEMBL2434397 0.87 F10 (0.56) F10NPC1RAB9A
SCHEMBL2433419 0.77 F10 (0.71) F10KCNH2F2
SCHEMBL2431776 0.77 F10 (0.58) F10KCNH2
SCHEMBL18914370 0.77 F10 (0.73) F10KCNH2F2
Trifluoroacetic Acid SCHEMBL6107006 0.77 F10 (0.55) F10KCNH2F2NPC1RAB9A
SCHEMBL2434258 0.76 F10 (0.54) F10KCNH2F2F9PRSS1
SCHEMBL21430146 0.76 F10 (0.75) F10KCNH2F2
SCHEMBL6714358 0.76 F10 (0.69) F10KCNH2F2NPC1RAB9A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2542529-B1 URETHANES, UREAS, AMIDINES AND RELATED INHIBITORS OF FACTOR XA LLC PHARMADIALL (RU) 2019-09-04 EP disclosed
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 1486/4885F2 10/4885

“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.