SCHEMBL4700552

SCHEMBL4700552

CC1CN(C(=O)C(C)(C)c2ccc(Cl)cc2)CCN1c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
CNR1 P21554 1/20 0.46
MAPK1 P28482 1/20 0.45
SMO Q99835 1/20 0.44
HSD11B1 P28845 2/20 0.44
ADAMTS5 Q9UNA0 12/20 0.44
MMP2 P08253 3/20 0.44
MMP14 P50281 2/20 0.44
FNTA P49354 1/20 0.43
FNTB P49356 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.43

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
SCHEMBL29748718 0.80 SMO (0.61) SMO
SCHEMBL6904992 0.76 MAPK1 (0.55) MAPK1ADAMTS5MMP2
SCHEMBL4703683 0.76 ADAMTS5 (0.44) MAPK1ADAMTS5MMP2
SCHEMBL348095 0.75 HSD11B1 (0.61) HSD11B1
SCHEMBL11082426 0.75 GFER (0.56) HSD11B1ADAMTS5MMP2
SCHEMBL4704927 0.75 HSD11B1 (0.59) HSD11B1
SCHEMBL656085 0.74 MEN1 (0.53) DRD2DRD4CNR1ADAMTS5MMP2
SCHEMBL652990 0.74 MEN1 (0.53) DRD2DRD4CNR1ADAMTS5MMP2
SCHEMBL652991 0.74 MEN1 (0.53) DRD2DRD4CNR1ADAMTS5MMP2
SCHEMBL20129676 0.74 GPR119 (0.55) MAPK1ADAMTS5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1758582-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2008-01-09 EP claimed
EP-1758582-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-03-07 EP claimed
US-20060009471-A1 Amido compounds and their use as pharmaceuticals INCYTE CORPORATION 2006-01-12 US claimed
WO-2006002349-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-01-05 WO claimed
EP-1758582-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2008-01-09 EP disclosed
EP-1758582-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-03-07 EP disclosed
US-20060009471-A1 Amido compounds and their use as pharmaceuticals INCYTE CORPORATION 2006-01-12 US disclosed
WO-2006002349-A1 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-01-05 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-20060009471-A1 Amido compounds and their use as pharmaceuticals HSD11B1, CYP11B1, HSD11B2 DRD2 2432/4885DRD4 3424/4885CNR1 516/4885

“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.