SCHEMBL17358596

SCHEMBL17358596

CC(C)C(NC(=O)OCc1ccccc1)C(=O)n1nnc2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 4/20 0.53
▸ CTSB P07858 3/20 0.53
▸ CTSK P43235 2/20 0.53
▸ ATM Q13315 1/20 0.52
▸ CAPN1 P07384 3/20 0.50
▸ CCR1 P32246 2/20 0.49
▸ CTSS P25774 3/20 0.48
▸ FAAH O00519 1/20 0.48
▸ ELANE P08246 2/20 0.44
▸ PRTN3 P24158 1/20 0.44
▸ ASAH1 Q13510 1/20 0.44

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
SCHEMBL24525683 1.00 CTSL (0.53) CTSLCTSBCTSKATMCAPN1
SCHEMBL31627772 0.81 FAAH (0.46) CTSLCTSBCTSKFAAHASAH1
SCHEMBL31627966 0.81 FAAH (0.46) CTSLCTSBCTSKFAAHASAH1
SCHEMBL17357685 0.80 CTSL (0.53) CTSLCTSBCTSKATMCAPN1
SCHEMBL14435181 0.80 CTSL (0.53) CTSLCTSBCTSKATMCTSS
SCHEMBL13434955 0.76 ATM (0.49) CTSLCTSBCTSKATMCTSS
SCHEMBL23388379 0.76 ASAH1 (0.51) CTSLCTSBCTSKCTSSFAAH
SCHEMBL2495018 0.76 GAA (0.55) FAAHASAH1
SCHEMBL220569 0.76 CTSL (0.63) CTSLCTSBCTSKATMCTSS
SCHEMBL1287168 0.76 CTSL (0.63) CTSLCTSBCTSKATMCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170143749-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Biopharma, Inc. 2017-05-25 — — US disclosed
US-20170143749-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Biopharma, Inc. 2017-05-25 — — US disclosed
US-20170143751-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Pharmaceuticals, Inc. 2017-05-25 — — US disclosed
US-20170143751-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Pharmaceuticals, Inc. 2017-05-25 — — US disclosed
US-9603863-B2 Substituted nucleosides, nucleotides and analogs thereof ALIOS BIOPHARMA, INC. (US) 2017-03-28 — — US disclosed
US-9603863-B2 Substituted nucleosides, nucleotides and analogs thereof ALIOS BIOPHARMA, INC. (US) 2017-03-28 — — US disclosed
US-20150366887-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Pharmaceuticals, Inc. 2015-12-24 — — US disclosed
US-20150366887-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF Janssen Pharmaceuticals, Inc. 2015-12-24 — — 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 (3 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-20170143749-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NT5C3B, TYMP CTSL 1285/4885CTSB 1591/4885CTSK 1993/4885
US-20170143751-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C3B CTSL 2826/4885CTSB 3328/4885CTSK 3804/4885
US-20150366887-A1 SUBSTITUTED NUCLEOSIDES, NUCLEOTIDES AND ANALOGS THEREOF PNP, NUDT1, NT5C3B CTSL 2826/4885CTSB 3328/4885CTSK 3804/4885

“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.

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