SCHEMBL7307204

SCHEMBL7307204

CCc1noc(-c2ncn3c2CN(C)C(=O)c2cc(F)ccc2-3)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.55
GABRP O00591 1/20 0.55
GABRD O14764 1/20 0.55
ALDH1A1 P00352 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2D6 P10635 1/20 0.55
GABRA1 P14867 1/20 0.55
TSHR P16473 1/20 0.55
GABRB1 P18505 1/20 0.55
GABRG2 P18507 1/20 0.55
GABRB3 P28472 1/20 0.55
GABRA5 P31644 1/20 0.55
CYP2C19 P33261 1/20 0.55
GABRA3 P34903 1/20 0.55
GABRA2 P47869 1/20 0.55
GABRB2 P47870 1/20 0.55
GABRA4 P48169 1/20 0.55
GABRE P78334 1/20 0.55
KMT2A Q03164 1/20 0.55
GABRA6 Q16445 1/20 0.55

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
SCHEMBL7393030 0.93 MEN1 (0.52) MEN1GABRPGABRDALDH1A1CYP1A2
SCHEMBL10630005 0.90 GABRA1 (0.52) MEN1GABRPGABRDALDH1A1CYP1A2
SCHEMBL10632027 0.90
SCHEMBL7312366 0.89 GABRG2 (0.64) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL7398879 0.89 GABRP (0.49) MEN1GABRPGABRDALDH1A1CYP1A2
SCHEMBL10632268 0.88
Hydrochloric Acid SCHEMBL7391492 0.88 GABRP (0.49) MEN1GABRPGABRDALDH1A1CYP1A2
SCHEMBL7394437 0.88 GABRP (0.51) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL10630010 0.87 GABRP (0.55) MEN1GABRPGABRDALDH1A1CYP1A2
SCHEMBL10627732 0.87 GABRA1 (0.52) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0109921-B1 BENZODIAZEPINE RECEPTORS AND THEIR PREPARATION A/S FERROSAN (DK) 1988-03-02 EP claimed
US-4507313-A Oxadiazolyl-imidazo-[1,4]benzodiazepines and their use in treatment of diseases of the central nervous system A/S FERROSAN (DK) 1985-03-26 US claimed
US-4507313-A Oxadiazolyl-imidazo-[1,4]benzodiazepines and their use in treatment of diseases of the central nervous system A/S FERROSAN (DK) 1985-03-26 US disclosed