SCHEMBL4862403

SCHEMBL4862403

CC(C)CC(CNCc1ccccc1)NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1cc2ccccc2n1C

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CTSL P07711 1/20 0.43
CTSS P25774 1/20 0.43
CYP2C9 P11712 2/20 0.40
TSHR P16473 2/20 0.40
CYP2C19 P33261 1/20 0.40
KCNH2 Q12809 1/20 0.40
GHSR Q92847 1/20 0.40
PHGDH O43175 1/20 0.39
CHRNA7 P36544 1/20 0.39
TACR1 P25103 3/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
CNR2 P34972 1/20 0.38
F10 P00742 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
SCHEMBL4823886 0.93 CTSL (0.43) CTSLCTSSCYP2C9TSHRCYP2C19
SCHEMBL4894630 0.91 CTSL (0.42) CTSLCTSSCYP2C9TSHRCYP2C19
SCHEMBL4827348 0.91 CTSL (0.41) CTSLCTSSCYP2C9TSHRCYP2C19
SCHEMBL4818135 0.89 CHRNA7 (0.42) CTSLCTSSCYP2C9TSHRCYP2C19
SCHEMBL4818236 0.89 CHRNA7 (0.42) CTSLCTSSCYP2C9TSHRCYP2C19
SCHEMBL8252425 0.87 CNR2 (0.43) CTSLCTSSCYP2C9TSHRCYP2C19
SCHEMBL4822019 0.86 CHRNA7 (0.40) CTSLCTSSCYP2C9TSHRCYP2C19
SCHEMBL4818266 0.85 CHRNA7 (0.39) CTSLCTSSCYP2C9TSHRCYP2C19
SCHEMBL4825000 0.85 F10 (0.42) CTSLCTSSCYP2C9TSHRCYP2C19
SCHEMBL4824814 0.84 F10 (0.43) CTSLCTSSKCNH2GHSRPHGDH

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 CTSL 12/4885CTSS 2/4885CYP2C9 1781/4885

“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.