SCHEMBL4363957

SCHEMBL4363957

CC(C)(Cc1cccc(-c2ccccc2)n1)OC(=O)N1CCNCC1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ P2RY12 Q9H244 10/20 0.41
▸ CKS1B P61024 2/20 0.39
▸ SKP1 P63208 2/20 0.39
▸ SKP2 Q13309 2/20 0.39
▸ MKNK2 Q9HBH9 2/20 0.39
▸ ACKR3 P25106 1/20 0.37
▸ SIGMAR1 Q99720 1/20 0.36
▸ PLAUR Q03405 1/20 0.36
▸ MAPK1 P28482 1/20 0.36

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
SCHEMBL4360123 0.83 FAAH (0.38) SIGMAR1MAPK1
SCHEMBL4369710 0.83 CXCR2 (0.37) —
SCHEMBL4358423 0.81 FAAH (0.40) —
SCHEMBL30254155 0.81 ALDH1A1 (0.45) MAPK1
SCHEMBL29155320 0.79 SIGMAR1 (0.45) SIGMAR1MAPK1
SCHEMBL4363955 0.71 P2RY12 (0.40) P2RY12CKS1BSKP1SKP2
SCHEMBL30020659 0.70 NAMPT (0.46) MKNK2
SCHEMBL25191894 0.70 HPGD (0.45) CKS1BSKP1SKP2MKNK2SIGMAR1
SCHEMBL7383181 0.70 CYP3A4 (0.40) SIGMAR1MAPK1
SCHEMBL3275117 0.69 CKS1B (0.65) CKS1BSKP1SKP2ACKR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090163508-A1 AMIDE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-25 — — 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-20090163508-A1 AMIDE COMPOUND FAAH, FAAH2, NAAA P2RY12 644/4885CKS1B 3175/4885SKP1 3469/4885

“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.

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