SCHEMBL1198673

SCHEMBL1198673

c1ccc2c(c1)[nH]c1cnc3c[nH]cc3c12

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 9/20 0.53
GABRG2 P18507 9/20 0.53
GABRB3 P28472 9/20 0.53
GABRA5 P31644 9/20 0.53
GABRA3 P34903 9/20 0.53
GABRA2 P47869 9/20 0.53
GABRP O00591 6/20 0.53
GABRD O14764 6/20 0.53
GABRB1 P18505 6/20 0.53
GABRB2 P47870 6/20 0.53
GABRA4 P48169 6/20 0.53
GABRE P78334 6/20 0.53
GABRA6 Q16445 6/20 0.53
GABRG1 Q8N1C3 6/20 0.53
GABRG3 Q99928 6/20 0.53
GABRQ Q9UN88 6/20 0.53
TOP2A P11388 1/20 0.46

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
SCHEMBL29388457 0.82 GABRA1 (0.59) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL3228276 0.82 GABRA1 (0.59) GABRA1GABRG2GABRB3GABRA5GABRA3
Iodide SCHEMBL9958847 0.81 GABRA1 (0.57) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL3233124 0.75 GABRA1 (0.61) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL12240630 0.75 GABRA1 (0.69) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL2358761 0.70 CDK4 (0.56) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL5576840 0.69 KDM4E (0.61) TOP2A
SCHEMBL3227604 0.69 GABRA1 (0.59) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL4512002 0.68 CDK4 (0.49) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL1173042 0.68 ALDH1A1 (0.67) GABRA1GABRG2GABRB3GABRA5GABRA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3862354-A1 INDOLOPYRIDINES AS EG5 KINESIN MODULATORS 4SC AG (DE) 2021-08-11 EP disclosed
EP-2824105-B1 Indolopyridines as Eg5 kinesin modulators 4SC AG (DE) 2021-03-31 EP disclosed
EP-2824105-A1 Indolopyridines as Eg5 kinesin modulators 4SC AG (DE) 2015-01-14 EP disclosed
US-8530493-B2 Indolopyridines as Eg5 kinesin modulators 4SC AG (DE) 2013-09-10 US disclosed
US-20110027226-A1 INDOLOPYRIDINES AS INHIBITORS OF THE KINESIN SPINDLE PROTEIN (EG5) 4SC AG (DE) 2011-02-03 US disclosed
EP-2178875-A1 INDOLOPYRIDINES AS INHIBITORS OF THE KINESIN SPINDLE PROTEIN (EG5 ) 4SC AG (DE) 2010-04-28 EP disclosed
US-20090246169-A1 INDOLOPYRIDINES AS EG5 KINESIN MODULATORS NYCOMED GMBH (DE) 2009-10-01 US disclosed
US-20090233902-A1 INDOLOPYRIDINES AS EG5 KINESIN MODULATORS 4SC AG (DE) 2009-09-17 US disclosed
WO-2009024190-A1 INDOLOPYRIDINES AS INHIBITORS OF THE KINESIN SPINDLE PROTEIN (EG5 ) 4SC AG (DE) 2009-02-26 WO disclosed
EP-1996592-A1 INDOLOPYRIDINES AS EG5 KINESIN MODULATORS Nycomed GmbH (DE) 2008-12-03 EP disclosed
EP-1994033-A1 INDOLOPYRIDINES AS EG5 KINESIN MODULATORS 4SC AG (DE) 2008-11-26 EP disclosed
WO-2007096395-A1 INDOLOPYRIDINES AS EG5 KINESIN MODULATORS 4SC AG (DE) 2007-08-30 WO disclosed
WO-2007096393-A1 INDOLOPYRIDINES AS EG5 KINESIN MODULATORS 4SC AG (DE) 2007-08-30 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 (3 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-20110027226-A1 INDOLOPYRIDINES AS INHIBITORS OF THE KINESIN SPINDLE PROTEIN (EG5) KIF5A, KIF5C, KIF5B GABRA1 4163/4885GABRG2 3872/4885GABRB3 3620/4885
US-20090233902-A1 INDOLOPYRIDINES AS EG5 KINESIN MODULATORS KIF5A, KIF5C, KIF5B GABRA1 4010/4885GABRG2 3511/4885GABRB3 3223/4885
US-20090246169-A1 INDOLOPYRIDINES AS EG5 KINESIN MODULATORS KIF5A, KIF5C, KIF5B GABRA1 4010/4885GABRG2 3511/4885GABRB3 3223/4885

“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.