SCHEMBL784619

SCHEMBL784619

Cc1cc(N2CCC(N(C)C(=O)c3ccc4c(c3)C(N(C)C(=O)Nc3cc(Cl)ccc3Cl)CC4)CC2)cc(C)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.43
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
USP30 Q70CQ3 1/20 0.37
TLR9 Q9NR96 1/20 0.36
TLR8 Q9NR97 1/20 0.36
TLR7 Q9NYK1 1/20 0.36
F2 P00734 1/20 0.36
PLAT P00750 1/20 0.36
KLKB1 P03952 1/20 0.36
CHRM4 P08173 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
UBE2M P61081 1/20 0.34
DCUN1D1 Q96GG9 1/20 0.34
NPY5R Q15761 4/20 0.34
PDK2 Q15119 1/20 0.33
JAK2 O60674 2/20 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
SCHEMBL785474 0.94 NPC1 (0.46) F10RAB9ANPC1USP30TLR9
SCHEMBL785958 0.92 F10 (0.38) F10RAB9ANPC1TLR9TLR8
SCHEMBL785694 0.91 F10 (0.41) F10RAB9AALDH1A1MAPT
SCHEMBL784621 0.91 UBE2M (0.37) F10TLR9TLR8TLR7KDM4E
SCHEMBL785223 0.90 F10 (0.43) F10RAB9ANPC1USP30MAPT
SCHEMBL784125 0.90 F10 (0.41) F10RAB9AUSP30TLR9TLR8
SCHEMBL785449 0.90 F10 (0.41) F10RAB9ANPC1USP30TLR9
SCHEMBL785369 0.89 F10 (0.38) F10TLR9TLR8TLR7UBE2M
SCHEMBL785210 0.88 USP30 (0.44) F10RAB9AUSP30TLR9TLR8
SCHEMBL785876 0.88 F10 (0.41) F10TLR9TLR8TLR7F2

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 524/4885RAB9A 1673/4885NPC1 2033/4885

“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.