SCHEMBL999320

SCHEMBL999320

CP(=O)(O)C(C(=O)NC=Cc1ccccc1)c1csc2ccc(Cl)cc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 18/20 1.00
PRSS1 P07477 1/20 0.52
PRSS2 P07478 1/20 0.52
CTSG P08311 1/20 0.52
PRSS3 P35030 1/20 0.52
ALDH1A1 P00352 2/20 0.40
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL999318 1.00 CMA1 (1.00) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL1083299 0.94 CMA1 (0.89) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL1083297 0.94 CMA1 (0.89) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL3651044 0.93 CMA1 (1.00) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL3651051 0.93 CMA1 (1.00) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL4127027 0.92 CMA1 (1.00) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL4127031 0.92 CMA1 (1.00) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL3136836 0.91 CMA1 (0.87) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL3136848 0.91 CMA1 (0.87) CMA1PRSS1PRSS2CTSGPRSS3
SCHEMBL7750696 0.91 CMA1 (0.88) CMA1PRSS1PRSS2CTSGPRSS3

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-8222431-B2 Process for synthesizing phosphonic and phosphinic acid compounds JANSSEN PHARMACEUTICA N.V. (BE) 2012-07-17 US claimed
JP-2011500682-A 2011-01-06 JP claimed
EP-2211867-A1 PROCESS FOR SYNTHESIZING PHOSPHONIC AND PHOSPHINIC ACID COMPOUNDS Janssen Pharmaceutica N.V. (BE) 2010-08-04 EP claimed
US-20090124801-A1 Process for synthesizing phosphonic and phosphinic acid compounds JANSSEN PHARMACEUTICA N.V. (BE) 2009-05-14 US claimed
WO-2009051746-A1 PROCESS FOR SYNTHESIZING PHOSPHONIC AND PHOSPHINIC ACID COMPOUNDS JANSSEN PHARMACEUTICA, N.V. (BE) 2009-04-23 WO claimed

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-20090124801-A1 Process for synthesizing phosphonic and phosphinic acid compounds CMA1, PPA1, CPN1 CMA1 1/4885PRSS1 72/4885PRSS2 127/4885

“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.