SCHEMBL9690282

SCHEMBL9690282

CCCCNc1c(C(=O)O)c(C)nc2c1c1ccccc1n2C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 7/20 0.56
GABRD O14764 7/20 0.56
GABRA1 P14867 7/20 0.56
GABRB1 P18505 7/20 0.56
GABRG2 P18507 7/20 0.56
GABRB3 P28472 7/20 0.56
GABRA5 P31644 7/20 0.56
GABRA3 P34903 7/20 0.56
GABRA2 P47869 7/20 0.56
GABRB2 P47870 7/20 0.56
GABRA4 P48169 7/20 0.56
GABRE P78334 7/20 0.56
GABRA6 Q16445 7/20 0.56
GABRG1 Q8N1C3 7/20 0.56
GABRG3 Q99928 7/20 0.56
GABRQ Q9UN88 7/20 0.56
UTS2R Q9UKP6 1/20 0.47
LMNA P02545 3/20 0.44
MEN1 O00255 2/20 0.44
USP2 O75604 2/20 0.44

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
SCHEMBL10463139 0.90 GABRP (0.61) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9690925 0.83 GABRP (0.78) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9690384 0.81 GABRP (0.61) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9689767 0.77 GABRP (0.59) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9688866 0.76 GABRP (0.76) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9688746 0.76 GABRP (0.58) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL9690331 0.74 GABRP (0.56) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL11797849 0.72 MAPT (0.45) LMNAMEN1USP2MAPK1KMT2A
SCHEMBL9691027 0.72 GABRP (0.54) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL5928052 0.71 MEN1 (0.80) LMNAMEN1USP2MAPK1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0249301-A1 Pyrido[2,3-b]indoles BEECHAM GROUP PLC (GB) 1987-12-16 EP claimed
EP-0249301-B1 Pyrido[2,3-b]indoles BEECHAM GROUP PLC (GB) 1992-05-27 EP disclosed
US-4952584-A TREATMENT OF PROPHYLAXIS OF ANXIETY OR DEPRESSION BEECHAM GROUP P.L.C. (GB) 1990-08-28 US disclosed
EP-0249301-A1 Pyrido[2,3-b]indoles BEECHAM GROUP PLC (GB) 1987-12-16 EP disclosed