SCHEMBL14193419

SCHEMBL14193419

Cn1c(C(=O)N[C@H]2CCCC[C@H]2C(=O)NCC(=O)Nc2ccccc2)cc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 1/20 0.46
▸ F10 P00742 6/20 0.45
▸ GHSR Q92847 2/20 0.44
▸ KCNH2 Q12809 1/20 0.44
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC2 Q92769 1/20 0.41
▸ MCL1 Q07820 1/20 0.40
▸ ROCK1 Q13464 1/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ CCKAR P32238 1/20 0.40
▸ CCKBR P32239 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ F2 P00734 1/20 0.39

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
SCHEMBL4822979 0.91 AHR (0.46) CHRNA7F10GHSRKCNH2ROCK1
SCHEMBL4823902 0.89 CHRNA7 (0.47) CHRNA7GHSRKCNH2HDAC1HDAC2
SCHEMBL4826756 0.88 CHRNA7 (0.47) CHRNA7GHSRKCNH2HDAC1HDAC2
SCHEMBL4818125 0.87 CNR2 (0.46) CHRNA7GHSRKCNH2HDAC1HDAC2
SCHEMBL4864692 0.87 CHRNA7 (0.45) CHRNA7GHSRKCNH2HDAC1HDAC2
SCHEMBL4823738 0.86 CHRNA7 (0.46) CHRNA7F10GHSRKCNH2HDAC1
SCHEMBL4823808 0.86 GHSR (0.47) CHRNA7GHSRKCNH2HDAC1HDAC2
SCHEMBL4822006 0.85 CHRNA7 (0.47) CHRNA7GHSRKCNH2HDAC1HDAC2
SCHEMBL8251025 0.84 CNR2 (0.50) CHRNA7GHSRKCNH2HDAC1HDAC2
SCHEMBL4822735 0.83 GHSR (0.47) CHRNA7GHSRKCNH2HDAC1HDAC2

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 4 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-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 3660/4885F10 634/4885GHSR 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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