SCHEMBL1136067

SCHEMBL1136067

CCCOc1ccc(F)c2c(=O)c(-c3ccc(C(=O)OC)cc3)c[nH]c12

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NLRP3 Q96P20 1/20 0.40
SGK1 O00141 1/20 0.38
CAMKK2 Q96RR4 1/20 0.38
PDE4D Q08499 1/20 0.38
ERN1 O75460 1/20 0.37
TTR P02766 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MET P08581 4/20 0.36
KDR P35968 3/20 0.36
PTGS1 P23219 1/20 0.35
MAPT P10636 1/20 0.35
PPARG P37231 1/20 0.35
EGFR P00533 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAP2K4 P45985 1/20 0.34
BCL9 O00512 1/20 0.34
CTNNB1 P35222 1/20 0.34

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
SCHEMBL1136243 0.90 SMN1; SMN2 (0.36) SGK1PDE4DALDH1A1METKDR
SCHEMBL1136154 0.90 PTPN11 (0.40) KDM4EPPARG
SCHEMBL1136107 0.87 MAPT (0.38) NLRP3PDE4DERN1METKDR
SCHEMBL1136266 0.86 MET (0.38) KDM4EALDH1A1METKDRMAPT
SCHEMBL1136230 0.86 MGAM (0.40) ALDH1A1METKDR
SCHEMBL1136119 0.85 MAOB (0.40) KDM4EALDH1A1METKDR
SCHEMBL2492033 0.84 MET (0.41) ERN1METKDRMAPT
SCHEMBL1136323 0.84 HPGD (0.48) KDM4EALDH1A1L3MBTL1
SCHEMBL1136343 0.83 FFAR4 (0.40) ALDH1A1METKDRMAPTTDP1
SCHEMBL2586505 0.83 FFAR1 (0.41) MAPTPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160304461-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2016-10-20 US disclosed
US-9403773-B2 Quinolone compound and pharmaceutical composition OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2016-08-02 US disclosed
US-20150218101-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-08-06 US disclosed
US-9045464-B2 Quinolone compound and pharmaceutical composition OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-06-02 US disclosed
US-20140121207-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-05-01 US disclosed
US-8642619-B2 Quinolone compound and pharmaceutical composition OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-02-04 US disclosed
US-20120316168-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-12-13 US disclosed
US-8269011-B2 Quinolone compound and pharmaceutical composition OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-09-18 US disclosed
EP-2152699-B1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMA CO LTD (JP) 2011-02-23 EP disclosed
US-20100130546-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2010-05-27 US disclosed
CN-101679392-A Quinolone compound and pharmaceutical composition OTSUKA PHARMA CO LTD 2010-03-24 CN 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-20120316168-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION PARK7, SNCA, LRRK2 NLRP3 379/4885SGK1 2341/4885CAMKK2 2359/4885
US-20140121207-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION PARK7, SNCA, LRRK2 NLRP3 379/4885SGK1 2341/4885CAMKK2 2359/4885
US-20160304461-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION PARK7, SNCA, LRRK2 NLRP3 379/4885SGK1 2341/4885CAMKK2 2359/4885
US-20100130546-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION PARK7, SNCA, LRRK2 NLRP3 379/4885SGK1 2341/4885CAMKK2 2359/4885
US-20150218101-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION PARK7, SNCA, LRRK2 NLRP3 379/4885SGK1 2341/4885CAMKK2 2359/4885

“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.