SCHEMBL1675113

SCHEMBL1675113

COc1cccc(Cn2c(C(=O)NC3CCN(c4ccncc4)CC3)cc3ccccc32)c1

nearest known ligand 0.74

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
F10 P00742 11/20 0.74
F2 P00734 2/20 0.58
DRD4 P21917 2/20 0.54
MCHR1 Q99705 2/20 0.50
PPARG P37231 1/20 0.50
SIGMAR1 Q99720 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
SCHEMBL15911269 0.88 F10 (0.58) F10F2DRD4MCHR1SIGMAR1
SCHEMBL1675311 0.88 F10 (0.59) F10F2DRD4PPARG
SCHEMBL1675257 0.85 F10 (1.00) F10F2DRD4
SCHEMBL1675000 0.84 F10 (0.70) F10F2
SCHEMBL1674998 0.81 F10 (0.61) F10F2DRD4MCHR1
SCHEMBL1675023 0.81 F10 (0.66) F10F2
SCHEMBL1674959 0.81 F10 (0.59) F10F2DRD4PPARG
SCHEMBL15911656 0.80 F10 (0.52) F10DRD4
SCHEMBL1675142 0.78 F10 (0.87) F10F2DRD4MCHR1
SCHEMBL1675042 0.78 F10 (0.87) F10F2DRD4

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
JP-4664592-B2 2011-04-06 JP claimed
EP-1451185-B1 INDOLE-2-CARBOXAMIDES AS FACTOR XA INHIBITORS SANOFI AVENTIS DEUTSCHLAND (DE) 2014-08-06 EP disclosed
US-20090069565-A1 NEW INDOLE DERIVATIVES AS FACTOR XA INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2009-03-12 US disclosed
US-20090069565-A1 NEW INDOLE DERIVATIVES AS FACTOR XA INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2009-03-12 US disclosed
WO-2003044014-A1 INDOLE-2-CARBOXAMIDES AS FACTOR XA INHIBITORS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2003-05-30 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-20090069565-A1 NEW INDOLE DERIVATIVES AS FACTOR XA INHIBITORS F12, F5, F2 F10 10/4885F2 3/4885DRD4 1029/4885

“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.