SCHEMBL7576170

SCHEMBL7576170

CCOC(=O)c1cn(C2CC2)c2nc(Cl)c(F)c(C)c2c1=O

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ STAT3 P40763 1/20 0.44
▸ ADRB2 P07550 1/20 0.44
▸ TSHR P16473 1/20 0.41
▸ CASP1 P29466 1/20 0.41
▸ TOP2A P11388 3/20 0.40
▸ TOP2B Q02880 3/20 0.40
▸ HTT P42858 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ KCNH2 Q12809 1/20 0.37
▸ HRH3 Q9Y5N1 1/20 0.37
▸ BAZ2B Q9UIF8 1/20 0.36
▸ BAZ2A Q9UIF9 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ POLB P06746 2/20 0.35
▸ HSD17B10 Q99714 1/20 0.35

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
SCHEMBL10379314 0.88 TOP2A (0.44) ADRB2TOP2ATOP2BKDM4EALDH1A1
SCHEMBL5874340 0.85 TOP2A (0.53) TOP2ATOP2BKCNH2HRH3MEN1
SCHEMBL8622610 0.83 ALDH1A1 (0.42) STAT3ADRB2TSHRCASP1TOP2A
SCHEMBL5422476 0.82 ADRB2 (0.51) STAT3ADRB2TOP2ATOP2BKDM4E
SCHEMBL10440758 0.82 PIM3 (0.54) STAT3ADRB2TSHRCASP1TOP2A
SCHEMBL9383700 0.82 PIM3 (0.54) STAT3ADRB2TSHRCASP1TOP2A
SCHEMBL10440780 0.82 PIM3 (0.43) STAT3ADRB2TSHRCASP1TOP2A
SCHEMBL8116592 0.82 ADRB2 (0.49) STAT3ADRB2TSHRCASP1TOP2A
SCHEMBL8111555 0.80 STAT3 (0.56) STAT3ADRB2TSHRCASP1TOP2A
SCHEMBL7582040 0.80 ADRB2 (0.44) ADRB2ALDH1A1BAZ2BBAZ2AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020049223-A1 Quinoline and naphthyridine carboxylic acid antibacterials ABBOTT LABORATORIES 2002-04-25 — — US disclosed
US-5585491-A Antibacterial agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1996-12-17 — — US disclosed
EP-0326891-B1 Antibacterial agents WARNER LAMBERT CO (US) 1994-08-03 — — EP disclosed
EP-0544981-A2 Naphthyridone carboxylic acid derivatives and antibacterial compositions containing them WARNER-LAMBERT COMPANY (US) 1993-06-09 — — EP disclosed
EP-0398967-A1 ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1990-11-28 — — EP disclosed
EP-0387802-A2 5-Substituted-1,4-dihydro-4-oxonaphthyridine-3-carboxylate antibacterial agents Bristol-Myers Squibb Company (US) 1990-09-19 — — EP disclosed
US-4920120-A 3-CARBOXY, 4-OXO, 6-FLUORO, 7-NITROGEN-CONTAINING RING 1,4-DIHYDRO-1,8-NAPHTHYRIDINES WARNER-LAMBERT COMPANY (US) 1990-04-24 — — US disclosed
EP-0326891-A2 Antibacterial agents WARNER-LAMBERT COMPANY (US) 1989-08-09 — — EP disclosed
WO-1989006649-A2 ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY (US) 1989-07-27 — — WO 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-20020049223-A1 Quinoline and naphthyridine carboxylic acid antibacterials NQO2, NQO1, NDUFA7 STAT3 3008/4885ADRB2 3198/4885TSHR 3942/4885

“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.

Send feedback