SCHEMBL6698030

SCHEMBL6698030

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

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MC4R P32245 2/20 0.40
MC3R P41968 2/20 0.40
MC5R P33032 1/20 0.40
CTSC P53634 1/20 0.39
DPP7 Q9UHL4 3/20 0.39
DPP4 P27487 2/20 0.39
FAP Q12884 1/20 0.39
DPP8 Q6V1X1 1/20 0.39
DPP9 Q86TI2 1/20 0.39
ROCK2 O75116 1/20 0.37
GPR142 Q7Z601 1/20 0.35
MC1R Q01726 1/20 0.35
POLB P06746 1/20 0.34
LMNA P02545 1/20 0.34
C5AR1 P21730 2/20 0.34
AKT1 P31749 2/20 0.34
AVPR1A P37288 1/20 0.33
KCNH2 Q12809 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
SCHEMBL6701494 0.91 MC3R (0.40) MC4RMC3RDPP7DPP4FAP
SCHEMBL6383837 0.89 ROCK2 (0.38) DPP7DPP4ROCK2KCNH2
SCHEMBL6698646 0.78 MEN1 (0.39) POLBAVPR1AKCNH2
SCHEMBL6701120 0.78 CTSB (0.49) POLBAVPR1A
SCHEMBL6705923 0.73 LSS (0.40) CTSC
SCHEMBL6300636 0.71 CTSL (0.41) LMNAAVPR1A
SCHEMBL6990244 0.71 TP53 (0.38) POLB
SCHEMBL6300222 0.70 CTSL (0.39)
SCHEMBL6702836 0.70 CTSL (0.41)
SCHEMBL6300585 0.69 CTSL (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 3 patents. 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
EP-1358176-A2 INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES Amura Therapeutics Limited (GB) 2003-11-05 EP disclosed
WO-2002057246-A2 INHIBITORS OF CRUZIPAIN AND OTHER CYSTEINE PROTEASES AMURA THERAPEUTICS LIMITED (GB) 2002-07-25 WO 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 MC4R 4329/4885MC3R 3846/4885MC5R 4211/4885

“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.