SCHEMBL14353447

SCHEMBL14353447

CCCOc1ccc(F)c2c(=O)c(-c3ccc(OC)cc3)cn(CCNC(=O)[C@H](Cc3c[nH]cn3)NC(=O)O)c12

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AXL P30530 3/20 0.33
CHRM1 P11229 1/20 0.33
CTSL P07711 5/20 0.33
CTSS P25774 4/20 0.33
PTPN1 P18031 1/20 0.32
GFER P55789 1/20 0.31
HDAC3 O15379 5/20 0.31
HDAC1 Q13547 5/20 0.31
HDAC2 Q92769 5/20 0.31
NCOR2 Q9Y618 3/20 0.31
CTSK P43235 1/20 0.31
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
HTT P42858 1/20 0.30
CLK1 P49759 1/20 0.30
RAB9A P51151 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
SCHEMBL14479942 0.93 CCKBR (0.36) PTPN1
SCHEMBL2581146 0.90 CHRM1 (0.33) AXLCHRM1CLK1RAB9A
SCHEMBL2581142 0.90 CHRM1 (0.33) AXLCHRM1CLK1RAB9A
SCHEMBL14353494 0.89 CHRM1 (0.37) CHRM1CTSLCTSSPTPN1GFER
SCHEMBL2584254 0.87 CHRM1 (0.31) CHRM1
SCHEMBL12175886 0.83 SCN9A (0.36) CHRM1PTPN1
SCHEMBL12175792 0.82 CHRM1 (0.36) CHRM1GFERHDAC1ALDH1A1CLK1
SCHEMBL12175875 0.81 MET (0.31)
Hydrochloric Acid SCHEMBL2585506 0.81 CHRM1 (0.36) CHRM1GFERHDAC1CLK1RAB9A
Hydrochloric Acid SCHEMBL2585508 0.81 CHRM1 (0.36) CHRM1GFERHDAC1CLK1RAB9A

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
EP-2364298-B1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMA CO LTD (JP) 2016-08-03 EP disclosed
US-9018229-B2 Quinolone compound and pharmaceutical composition OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-04-28 US disclosed
US-20140045793-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-02-13 US disclosed
US-8592593-B2 Quinolone compound and pharmaceutical composition OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-11-26 US disclosed
US-20130005675-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-03 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 (2 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-20130005675-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION PARK7, SNCA, LRRK2 AXL 3657/4885CHRM1 170/4885CTSL 3502/4885
US-20140045793-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION PARK7, SNCA, LRRK2 AXL 3657/4885CHRM1 170/4885CTSL 3502/4885

“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.