SCHEMBL9690837

SCHEMBL9690837

Cc1nc2c(c(N)c1OC(=O)O)c1ccccc1n2C

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 9/20 0.64
GABRD O14764 9/20 0.64
GABRA1 P14867 9/20 0.64
GABRB1 P18505 9/20 0.64
GABRG2 P18507 9/20 0.64
GABRB3 P28472 9/20 0.64
GABRA5 P31644 9/20 0.64
GABRA3 P34903 9/20 0.64
GABRA2 P47869 9/20 0.64
GABRB2 P47870 9/20 0.64
GABRA4 P48169 9/20 0.64
GABRE P78334 9/20 0.64
GABRA6 Q16445 9/20 0.64
GABRG1 Q8N1C3 9/20 0.64
GABRG3 Q99928 9/20 0.64
GABRQ Q9UN88 9/20 0.64
HKDC1 Q2TB90 1/20 0.42
RXFP1 Q9HBX9 2/20 0.39
HPGD P15428 1/20 0.39
PKM P14618 1/20 0.38

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
SCHEMBL9689797 0.88 GABRP (0.68) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9688866 0.81 GABRP (0.76) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9688937 0.78 GABRP (0.50) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9690410 0.75 GABRP (0.57) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7554133 0.74 HSD17B10 (0.60) HPGDKMT2AALDH1A1TP53HSD17B10
SCHEMBL9690884 0.74 GABRP (0.56) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9688905 0.73 GABRP (0.52) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9689767 0.72 GABRP (0.59) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9688927 0.72 GABRP (0.79) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9690370 0.72 EGFR (0.42) GABRPGABRDGABRA1GABRB1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0249301-B1 Pyrido[2,3-b]indoles BEECHAM GROUP PLC (GB) 1992-05-27 EP claimed