SCHEMBL2707296

SCHEMBL2707296

Cc1ccc(-c2csc(COc3ccc(F)c(C(N)=O)c3F)n2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.54
L3MBTL1 Q9Y468 6/20 0.54
ALDH1A1 P00352 3/20 0.54
PPARD Q03181 4/20 0.47
NPC1 O15118 4/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
PPARA Q07869 2/20 0.46
POLB P06746 1/20 0.45
TDP1 Q9NUW8 1/20 0.43
MEN1 O00255 2/20 0.43
BCHE P06276 1/20 0.42
LMNA P02545 1/20 0.40
MAPT P10636 4/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GFER P55789 1/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 2/20 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
SCHEMBL2705816 0.91 L3MBTL1 (0.53) RAB9AL3MBTL1ALDH1A1PPARDNPC1
SCHEMBL204423 0.91 L3MBTL1 (0.45) RAB9AL3MBTL1ALDH1A1PPARDNPC1
SCHEMBL2704589 0.90 PPARD (0.52) RAB9AL3MBTL1ALDH1A1PPARDNPC1
SCHEMBL19210500 0.90 L3MBTL1 (0.43) RAB9AL3MBTL1ALDH1A1PPARDNPC1
SCHEMBL203280 0.90 L3MBTL1 (0.59) RAB9AL3MBTL1ALDH1A1PPARDNPC1
SCHEMBL201521 0.89 PPARD (0.49) RAB9AL3MBTL1ALDH1A1PPARDNPC1
SCHEMBL2707366 0.88 L3MBTL1 (0.55) RAB9AL3MBTL1ALDH1A1PPARDNPC1
SCHEMBL19471075 0.88 L3MBTL1 (0.42) RAB9AL3MBTL1ALDH1A1PPARDNPC1
SCHEMBL201173 0.87 L3MBTL1 (0.43) RAB9AL3MBTL1ALDH1A1PPARDNPC1
SCHEMBL2706162 0.86 HDAC3 (0.48) RAB9AL3MBTL1ALDH1A1PPARDNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170305943-A1 COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS TAXIS PHARMACEUTICALS, INC. (US) 2017-10-26 US disclosed
US-20150191420-A1 ANTIBACTERIAL AGENTS TAXIS PHARMACEUTICALS, INC. 2015-07-09 US disclosed
US-8865736-B2 Antibacterial agents Biota Scientific Pty Ltd (AU) 2014-10-21 US disclosed
US-20130072520-A2 ANTIBACTERIAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2013-03-21 US disclosed
US-20120122918-A1 ANTIBACTERIAL AGENTS BIOTA SCIENTIFIC MANAGEMENT PTY LTD (AU) 2012-05-17 US disclosed
US-8088791-B2 Antibacterial agents Biots Scientific Management Pty Ltd (AU) 2012-01-03 US disclosed
US-20100173933-A1 ANTIBACTERIAL AGENTS PROLYSIS LTD (GB) 2010-07-08 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 (5 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-20120122918-A1 ANTIBACTERIAL AGENTS ALK, ROS1, ARG1 RAB9A 1213/4885L3MBTL1 297/4885ALDH1A1 787/4885
US-20130072520-A2 ANTIBACTERIAL AGENTS ALK, ROS1, NOX1 RAB9A 2799/4885L3MBTL1 703/4885ALDH1A1 800/4885
US-20150191420-A1 ANTIBACTERIAL AGENTS ALK, ARG1, ROS1 RAB9A 1340/4885L3MBTL1 377/4885ALDH1A1 740/4885
US-20170305943-A1 COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS ELANE, MMP8, NISCH RAB9A 3841/4885L3MBTL1 384/4885ALDH1A1 1874/4885
US-20100173933-A1 ANTIBACTERIAL AGENTS ALK, ROS1, NOX1 RAB9A 2799/4885L3MBTL1 703/4885ALDH1A1 800/4885

“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.