SCHEMBL4826176

SCHEMBL4826176

Cn1c(C(=O)N[C@H]2CCCC[C@H]2C(=O)NCc2cc3ccccc3[nH]2)cc2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SSTR3 P32745 1/20 0.52
▸ RAB9A P51151 1/20 0.43
▸ CHRNA7 P36544 1/20 0.42
▸ GHSR Q92847 2/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ CNR2 P34972 1/20 0.39
▸ ITGB3 P05106 1/20 0.39
▸ ITGAV P06756 1/20 0.39
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC2 Q92769 1/20 0.38
▸ METTL3 Q86U44 1/20 0.38
▸ METTL14 Q9HCE5 1/20 0.38
▸ TACR1 P25103 1/20 0.38
▸ CCKAR P32238 1/20 0.38
▸ CCKBR P32239 1/20 0.38
▸ GID4 Q8IVV7 1/20 0.37

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
SCHEMBL4822006 0.82 CHRNA7 (0.47) RAB9ACHRNA7GHSRKCNH2CNR2
SCHEMBL4823902 0.82 CHRNA7 (0.47) RAB9ACHRNA7GHSRKCNH2CNR2
SCHEMBL8251025 0.82 CNR2 (0.50) RAB9ACHRNA7GHSRKCNH2CNR2
SCHEMBL4826756 0.82 CHRNA7 (0.47) RAB9ACHRNA7GHSRKCNH2CNR2
SCHEMBL5259022 0.81 CHRNA7 (0.46) CHRNA7GHSRKCNH2CNR2HDAC1
SCHEMBL4825563 0.81 CHRNA7 (0.46) CHRNA7GHSRKCNH2CNR2HDAC1
SCHEMBL4825614 0.81 HPGD (0.46) RAB9ACHRNA7GHSR
SCHEMBL14193441 0.81 CHRNA7 (0.51) RAB9ACHRNA7GHSRKCNH2CNR2
SCHEMBL4825471 0.81 CHRNA7 (0.46) RAB9ACHRNA7GHSRKCNH2CNR2
SCHEMBL4823808 0.81 GHSR (0.47) CHRNA7GHSRKCNH2CNR2HDAC1

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 SSTR3 1379/4885RAB9A 407/4885CHRNA7 3660/4885

“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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