SCHEMBL2433780

SCHEMBL2433780

CNc1ccc(C(=O)Nc2ccc(C)cc2C(=O)Nc2ccc(Cl)cn2)cc1

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 19/20 0.73
TP53 P04637 1/20 0.65
TSHR P16473 1/20 0.65
NFKB1 P19838 1/20 0.65
RAB9A P51151 1/20 0.65
NFKB2 Q00653 1/20 0.65
RELA Q04206 1/20 0.65
SMN1; SMN2 Q16637 1/20 0.65
KCNH2 Q12809 1/20 0.62
KLKB1 P03952 3/20 0.61

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
SCHEMBL2433664 0.92 F10 (0.78) F10KCNH2KLKB1
SCHEMBL6215501 0.87 F10 (0.70) F10TP53TSHRNFKB1RAB9A
SCHEMBL2434887 0.87 F10 (0.75) F10KCNH2KLKB1
SCHEMBL2438689 0.87 F10 (0.59) F10TP53TSHRNFKB1RAB9A
SCHEMBL12326032 0.86 F10 (0.66) F10TP53TSHRNFKB1RAB9A
SCHEMBL2436713 0.86 F10 (0.72) F10
SCHEMBL799832 0.85 F10 (0.72) F10TP53TSHRNFKB1RAB9A
SCHEMBL6105601 0.85 F10 (0.70) F10KCNH2KLKB1
SCHEMBL2431132 0.85 F10 (0.73) F10KCNH2KLKB1
SCHEMBL799840 0.85 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 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 9/4885TP53 4789/4885TSHR 1899/4885

“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.