SCHEMBL4824140

SCHEMBL4824140

NC(=O)[C@H]1CCCC[C@H]1C(=O)NCC(=O)NCCO

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 2/20 0.39
PSEN1 P49768 4/20 0.39
PSEN2 P49810 4/20 0.39
APH1B Q8WW43 4/20 0.39
NCSTN Q92542 4/20 0.39
APH1A Q96BI3 4/20 0.39
PSENEN Q9NZ42 4/20 0.39
EPHX1 P07099 1/20 0.37
TAAR1 Q96RJ0 3/20 0.35
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
CTSB P07858 1/20 0.34
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
HSD17B10 Q99714 2/20 0.33
CASP1 P29466 1/20 0.33

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
SCHEMBL4598382 0.89 GRM4 (0.44) GRM4PSEN1PSEN2APH1BNCSTN
SCHEMBL4824145 0.84 CACNA1G (0.34) TAAR1ALDH1A1CTSBCTSSCTSK
SCHEMBL12565677 0.79 TAAR1 (0.49) GRM4TAAR1ALDH1A1CTSBCTSS
SCHEMBL4826154 0.77 GRM4 (0.46) GRM4PSEN1PSEN2APH1BNCSTN
SCHEMBL4598374 0.75 GRM4 (0.44) GRM4PSEN1PSEN2APH1BNCSTN
SCHEMBL4824953 0.75 GRM4 (0.44) GRM4PSEN1PSEN2APH1BNCSTN
SCHEMBL9517661 0.73 GRM4 (0.43) GRM4PSEN1PSEN2APH1BNCSTN
SCHEMBL4817714 0.73 MAPT (0.50) GRM4EPHX1TAAR1ALDH1A1LMNA
SCHEMBL16360896 0.72 F2 (0.43) GRM4PSEN1PSEN2APH1BNCSTN
SCHEMBL4598385 0.71 TAAR1 (0.40) GRM4TAAR1ALDH1A1HSD17B10CASP1

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 claimed
US-20070032484-A1 Cathepsin K inhibitors ROCHE PALO ALTO LLC 2007-02-08 US claimed
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

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 GRM4 4622/4885PSEN1 1444/4885PSEN2 2814/4885

“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.