SCHEMBL7369561

SCHEMBL7369561

Cc1c[nH]c2ccc(-n3cnc4cc(C(C)c5ccccc5)ccc43)cc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 14/20 0.47
GABRD O14764 14/20 0.47
GABRA1 P14867 14/20 0.47
GABRB1 P18505 14/20 0.47
GABRG2 P18507 14/20 0.47
GABRB3 P28472 14/20 0.47
GABRA5 P31644 14/20 0.47
GABRA3 P34903 14/20 0.47
GABRA2 P47869 14/20 0.47
GABRB2 P47870 14/20 0.47
GABRA4 P48169 14/20 0.47
GABRE P78334 14/20 0.47
GABRA6 Q16445 14/20 0.47
GABRG1 Q8N1C3 14/20 0.47
GABRG3 Q99928 14/20 0.47
GABRQ Q9UN88 14/20 0.47
FGFR1 P11362 4/20 0.43
HTR1A P08908 1/20 0.39
HTR1D P28221 1/20 0.39
F9 P00740 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
SCHEMBL7374293 0.87 GABRP (0.49) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL8884702 0.83 GABRP (0.59) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7373806 0.81 GABRP (0.66) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7410803 0.81 GABRP (0.65) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7369565 0.80 GABRP (0.48) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7374946 0.79 GABRP (0.59) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7374398 0.77 GABRP (0.51) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7371386 0.77 FGFR1 (0.57) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7376915 0.76 GABRP (0.57) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL7371338 0.74 GABRP (0.49) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5688809-A 5-heteroarylindole derivatives PFIZER INC. (US) 1997-11-18 US disclosed
EP-0743942-A1 5-HETEROARYLINDOLE DERIVATIVES AS BENZODIAZEPINE RECEPTOR SITE AGONISTS AND ANTAGONISTS PFIZER INC. (US) 1996-11-27 EP disclosed
WO-1995021836-A1 5-HETEROARYLINDOLE DERIVATIVES AS BENZODIAZEPINE RECEPTOR SITE AGONISTS AND ANTAGONISTS PFIZER INC. (US) 1995-08-17 WO disclosed