SCHEMBL4822909

SCHEMBL4822909

Cn1c(C(=O)N[C@H]2CCCC[C@H]2C(=O)NCC(=O)COCc2ccccc2)cc2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 3/20 0.44
▸ GHSR Q92847 2/20 0.41
▸ KCNH2 Q12809 1/20 0.41
▸ CHRNA7 P36544 1/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ CTSL P07711 2/20 0.40
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ CNR2 P34972 1/20 0.38
▸ MCL1 Q07820 1/20 0.38
▸ SRD5A2 P31213 1/20 0.37
▸ ADAM17 P78536 1/20 0.37
▸ CTSB P07858 1/20 0.37
▸ CTSK P43235 1/20 0.37
▸ CPB1 P15086 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
SCHEMBL4822735 0.89 GHSR (0.47) GHSRKCNH2CHRNA7MEN1KMT2A
SCHEMBL4823902 0.86 CHRNA7 (0.47) GHSRKCNH2CHRNA7MEN1KMT2A
SCHEMBL4823808 0.85 GHSR (0.47) CTSSGHSRKCNH2CHRNA7MEN1
SCHEMBL4826821 0.84 CPB1 (0.49) CTSSGHSRKCNH2CHRNA7MEN1
SCHEMBL4826756 0.84 CHRNA7 (0.47) GHSRKCNH2CHRNA7MEN1KMT2A
SCHEMBL4864692 0.84 CHRNA7 (0.45) GHSRKCNH2CHRNA7MEN1KMT2A
SCHEMBL4817689 0.84 TAAR1 (0.52) GHSRKCNH2CHRNA7MEN1KMT2A
SCHEMBL4822710 0.82 HDAC1 (0.46) CHRNA7MEN1KMT2ACNR2
SCHEMBL14193419 0.82 CHRNA7 (0.46) GHSRKCNH2CHRNA7MEN1KMT2A
SCHEMBL4826975 0.81 HDAC1 (0.47) CHRNA7KMT2ACNR2

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 CTSS 2/4885GHSR 686/4885KCNH2 2060/4885

“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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