SCHEMBL6701494

SCHEMBL6701494

NC(Cc1ccc(F)cc1)C(=O)NC12CCCC1OCC2=O

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MC3R P41968 4/20 0.40
MC4R P32245 3/20 0.40
DPP4 P27487 4/20 0.39
FAP Q12884 2/20 0.39
DPP8 Q6V1X1 2/20 0.39
DPP9 Q86TI2 2/20 0.39
DPP7 Q9UHL4 2/20 0.39
TPH1 P17752 2/20 0.36
GPR142 Q7Z601 1/20 0.36
POLB P06746 1/20 0.35
MC1R Q01726 1/20 0.35

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
SCHEMBL6700410 0.92 ITGA4 (0.40)
SCHEMBL6698030 0.91 MC4R (0.40) MC3RMC4RDPP4FAPDPP8
SCHEMBL6383837 0.86 ROCK2 (0.38) DPP4DPP7
SCHEMBL6295858 0.78 EPHX1 (0.33) MC3RMC4RPOLBMC1R
SCHEMBL6696901 0.78 USP30 (0.42)
SCHEMBL6294795 0.77 CTSB (0.49)
SCHEMBL6992575 0.76 USP30 (0.48)
SCHEMBL6703064 0.74 HPGDS (0.47)
SCHEMBL6300585 0.70 CTSL (0.39)
SCHEMBL6988909 0.69 SLC6A3 (0.39)

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040106805-A1 Inhibitors of cruzipain and other cysteine proteases AMURA THERAPEUTICS LIMITED (GB) 2004-06-03 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-20040106805-A1 Inhibitors of cruzipain and other cysteine proteases CTRL, CPN1, CPA1 MC3R 3846/4885MC4R 4329/4885DPP4 398/4885

“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.