SCHEMBL784572

SCHEMBL784572

CN(C(=O)NC1CCc2ccc(C(=O)N(C)C3CCN(c4ccc5cnccc5c4)CC3)cc21)c1ccc(Cl)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 9/20 0.39
F2 P00734 1/20 0.35
PLAT P00750 1/20 0.35
KLKB1 P03952 1/20 0.35
NPY5R Q15761 5/20 0.35
USP30 Q70CQ3 1/20 0.34
CNR1 P21554 1/20 0.34
JAK2 O60674 3/20 0.33
JAK1 P23458 3/20 0.33
CTSS P25774 1/20 0.33

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
SCHEMBL785530 0.92 JAK2 (0.37) F10NPY5RUSP30JAK2JAK1
SCHEMBL784689 0.88 F10 (0.39) F10F2PLATKLKB1USP30
SCHEMBL784715 0.87 F10 (0.40) F10F2PLATKLKB1NPY5R
SCHEMBL784713 0.87 F10 (0.42) F10F2PLATKLKB1NPY5R
SCHEMBL785033 0.86 F10 (0.41) F10NPY5RCTSS
SCHEMBL785321 0.86 F10 (0.39) F10F2PLATKLKB1NPY5R
SCHEMBL784571 0.86 TRPV1 (0.41) F10F2PLATKLKB1
SCHEMBL784656 0.84 ABL1 (0.40) F10NPY5RCTSS
SCHEMBL784402 0.84 CTSS (0.40) F10USP30CNR1JAK2JAK1
SCHEMBL785714 0.83 TRPV1 (0.38) F10NPY5RUSP30JAK2JAK1

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-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US claimed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 US claimed
US-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US disclosed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 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-20120071461-A1 Substituted Benzamide Compounds BDKRB1, BDKRB2, HRH2 F10 524/4885F2 455/4885PLAT 1347/4885

“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.