SCHEMBL1531797

SCHEMBL1531797

CCc1sc(C(C)=O)nc1C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.38
COPS5 Q92905 5/20 0.35
HCAR2 Q8TDS4 2/20 0.33
USP2 O75604 1/20 0.30
NPC1 O15118 2/20 0.30
RAB9A P51151 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL1548680 0.81 COPS5 (0.40) L3MBTL1COPS5HCAR2USP2NPC1
SCHEMBL3838148 0.77 L3MBTL1 (0.43) L3MBTL1COPS5HCAR2NPC1RAB9A
SCHEMBL22774382 0.77 L3MBTL1 (0.40) L3MBTL1COPS5HCAR2NPC1RAB9A
SCHEMBL11183274 0.76 L3MBTL1 (0.39) L3MBTL1COPS5HCAR2NPC1RAB9A
SCHEMBL755522 0.76 ALDH1A1 (0.44) L3MBTL1COPS5HCAR2NPC1RAB9A
Bromide SCHEMBL7136559 0.74 COPS5 (0.52) L3MBTL1COPS5ALDH1A1
SCHEMBL1548237 0.73 L3MBTL1 (0.38) L3MBTL1COPS5HCAR2NPC1RAB9A
SCHEMBL1548276 0.73 L3MBTL1 (0.38) L3MBTL1COPS5HCAR2NPC1RAB9A
SCHEMBL1548239 0.73 L3MBTL1 (0.38) L3MBTL1COPS5HCAR2NPC1RAB9A
SCHEMBL28135175 0.71 L3MBTL1 (0.36) L3MBTL1COPS5HCAR2NPC1RAB9A

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
EP-2292639-B1 Tubulisine derivatives as anticancer drugs KEMOTECH S R L (IT) 2014-09-03 EP disclosed
US-8580820-B2 Tubulysin compounds with high cytotoxicity, pharmaceutical compositions thereof, and method of use thereof KEMTECH S.R.L. (IT) 2013-11-12 US disclosed
US-20110200581-A1 PHARMACEUTICAL COMPOSITIONS KEMOTECH S.r.I (IT) 2011-08-18 US disclosed
EP-2292639-A1 Tubulisine derivatives as anticancer drugs Kemotech S.r.l. (IT) 2011-03-09 EP 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-20110200581-A1 PHARMACEUTICAL COMPOSITIONS NR1H3, NR1H2, CCR8 L3MBTL1 3449/4885COPS5 836/4885HCAR2 555/4885

“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.