SCHEMBL4393218

SCHEMBL4393218

COCC1C(=O)N(Cc2ccc3c(N)ncnc3c2)CCN1C(=O)COc1ccc(SC(F)(F)F)cc1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 12/20 0.38
CCR1 P32246 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 1/20 0.31
NTRK1 P04629 1/20 0.31
CSF1R P07333 1/20 0.31
NTRK2 Q16620 1/20 0.31
IGF1R P08069 1/20 0.31
MAPK7 Q13164 1/20 0.31

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
SCHEMBL1651492 1.00 F10 (0.38) F10CCR1SMN1; SMN2HCRTR1HCRTR2
SCHEMBL4388028 0.90 CCR1 (0.41) F10CCR1
SCHEMBL4388026 0.90 CCR1 (0.41) F10CCR1
SCHEMBL1384912 0.89 F10 (0.41) F10CCR1
SCHEMBL4387720 0.88 F10 (0.46) F10CCR1SMN1; SMN2
SCHEMBL4387723 0.88 F10 (0.46) F10CCR1SMN1; SMN2
SCHEMBL1652915 0.85 F10 (0.42) F10CCR1
SCHEMBL4395019 0.85 F10 (0.42) F10CCR1
SCHEMBL1652671 0.85 F10 (0.40) F10
SCHEMBL4391168 0.85 F10 (0.40) F10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040102450-A1 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2004-05-27 US claimed
US-7612075-B2 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2009-11-03 US disclosed
US-20040102450-A1 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2004-05-27 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-20040102450-A1 Substituted oxoazaheterocyclyl compounds F13B, F9, F11 F10 12/4885CCR1 2932/4885SMN1; SMN2 4142/4885

“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.