SCHEMBL4825167

SCHEMBL4825167

Cn1c(C(=O)N[C@H]2CCCC[C@H]2C(=O)NCc2ccc3c(n2)CCCC3)cc2ccccc21

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 1/20 0.40
▸ ADAM17 P78536 3/20 0.39
▸ GHSR Q92847 2/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ CCKAR P32238 3/20 0.37
▸ CCKBR P32239 3/20 0.37
▸ CNR2 P34972 1/20 0.37
▸ KDM1A O60341 1/20 0.37
▸ HDAC1 Q13547 1/20 0.36
▸ HDAC2 Q92769 1/20 0.36
▸ HSD17B13 Q7Z5P4 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
SCHEMBL4827419 0.86 ADAM17 (0.44) CHRNA7ADAM17GHSRCCKARCCKBR
SCHEMBL4825614 0.84 HPGD (0.46) CHRNA7ADAM17GHSR
SCHEMBL4819428 0.83 ADAM17 (0.44) CHRNA7ADAM17GHSRKCNH2CCKAR
SCHEMBL4826756 0.79 CHRNA7 (0.47) CHRNA7GHSRKCNH2CCKARCCKBR
SCHEMBL8251025 0.79 CNR2 (0.50) CHRNA7GHSRKCNH2CNR2HDAC1
SCHEMBL4822006 0.79 CHRNA7 (0.47) CHRNA7GHSRKCNH2CCKARCCKBR
SCHEMBL4823902 0.79 CHRNA7 (0.47) CHRNA7GHSRKCNH2CCKARCCKBR
SCHEMBL5259022 0.79 CHRNA7 (0.46) CHRNA7GHSRKCNH2CNR2HDAC1
SCHEMBL4825563 0.79 CHRNA7 (0.46) CHRNA7GHSRKCNH2CCKARCCKBR
SCHEMBL14193441 0.78 CHRNA7 (0.51) CHRNA7GHSRKCNH2CCKARCCKBR

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
US-7358373-B2 Cathepsin K inhibitors ROCHE PALO ALTO LLC (US) 2008-04-15 — — US disclosed
US-7358373-B2 Cathepsin K inhibitors ROCHE PALO ALTO LLC (US) 2008-04-15 — — US disclosed
US-7358373-B2 Cathepsin K inhibitors ROCHE PALO ALTO LLC (US) 2008-04-15 — — US disclosed
US-20070032484-A1 Cathepsin K inhibitors ROCHE PALO ALTO LLC 2007-02-08 — — US disclosed
US-20070032484-A1 Cathepsin K inhibitors ROCHE PALO ALTO LLC 2007-02-08 — — 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-20070032484-A1 Cathepsin K inhibitors CTSK, CTSS, CTSF CHRNA7 3660/4885ADAM17 171/4885GHSR 686/4885

“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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