SCHEMBL4269239

SCHEMBL4269239

NCc1nc2c(F)cc(F)cc2[nH]1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F10 P00742 2/20 0.51
IDO1 P14902 1/20 0.45
CACNA1H O95180 5/20 0.42
EGLN1 Q9GZT9 1/20 0.42
SSTR5 P35346 8/20 0.39
SLC40A1 Q9NP59 1/20 0.35
CACNA1C Q13936 2/20 0.33
CACNA1B Q00975 1/20 0.33
CACNA1G O43497 1/20 0.33

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
SCHEMBL15844337 0.88 IDO1 (0.59) F10IDO1CACNA1HEGLN1SSTR5
SCHEMBL29439058 0.82 F10 (0.48) F10IDO1CACNA1HEGLN1SSTR5
SCHEMBL17276072 0.76 PNP (0.47) F10IDO1EGLN1SSTR5
SCHEMBL4270442 0.75 EGLN1 (0.42) IDO1CACNA1HEGLN1SLC40A1
SCHEMBL1170829 0.75 EGLN1 (0.43) F10EGLN1SSTR5
Hydrochloric Acid SCHEMBL23782097 0.74 EGLN1 (0.41) IDO1CACNA1HEGLN1SLC40A1
Hydrochloric Acid SCHEMBL23497492 0.74 EGLN1 (0.41) IDO1CACNA1HEGLN1SLC40A1
Hydrochloric Acid SCHEMBL23497490 0.72 EGLN1 (0.40) IDO1CACNA1HEGLN1SLC40A1
SCHEMBL20919865 0.72 EGLN1 (0.41) F10EGLN1SSTR5
SCHEMBL2105970 0.72 EGLN1 (0.41) F10IDO1EGLN1SSTR5

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-7534793-B2 Aminopiperidine quinolines and their azaisosteric analogues with antibacterial activity SMITHKLINE BEECHAM P.L.C. (GB) 2009-05-19 US disclosed
EP-1305308-B1 AMINOPIPERIDINE QUINOLINES AND THEIR AZAISOSTERIC ANALOGUES WITH ANTIBACTERIAL ACTIVITY SMITHKLINE BEECHAM PLC (GB) 2006-12-20 EP disclosed
US-20060014749-A1 Aminopiperidine quinolines and their azaisosteric analogues with antibacterial activity SMITHKLINE BEECHAM P.L.C. 2006-01-19 US disclosed
US-6962917-B2 Aminopiperidine quinolines and their azaisosteric analogues with antibacterical activity SMITHKLINE BEECHAM P.L.C. (GB) 2005-11-08 US disclosed
US-20040038998-A1 Aminopiperidine quinolines and their azaisosteric analogues with antibacterical activity SMITHKLINE BEECHAM P.L.C. (GB) 2004-02-26 US disclosed
EP-1305308-A1 AMINOPIPERIDINE QUINOLINES AND THEIR AZAISOSTERIC ANALOGUES WITH ANTIBACTERIAL ACTIVITY SMITHKLINE BEECHAM PLC (GB) 2003-05-02 EP disclosed
WO-2002008224-A1 AMINOPIPERIDINE QUINOLINES AND THEIR AZAISOSTERIC ANALOGUES WITH ANTIBACTERIAL ACTIVITY SMITHKLINE BEECHAM P.L.C. (GB) 2002-01-31 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 (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-20040038998-A1 Aminopiperidine quinolines and their azaisosteric analogues with antibacterical activity AZI2, AMPD2, AMPD1 F10 4648/4885IDO1 507/4885CACNA1H 2798/4885
US-20060014749-A1 Aminopiperidine quinolines and their azaisosteric analogues with antibacterial activity AZI2, NPEPPS, AMPD2 F10 4747/4885IDO1 563/4885CACNA1H 3680/4885

“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.