Clotiazepam

Clotiazepam

SCHEMBL6130078

CCc1cc2c(s1)N(C)C(=O)CN=C2c1ccccc1Cl.O=C1CN=C(c2ccccc2)c2cc([N+](=O)[O-])ccc2N1

nearest known ligand 0.64

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ

The experimentally established mechanism targets of Clotiazepam. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 known ✓ P14867 7/20 0.64
GABRA5 known ✓ P31644 7/20 0.64
GABRA3 known ✓ P34903 7/20 0.64
GABRA2 known ✓ P47869 6/20 0.64
GABRG2 known ✓ P18507 6/20 0.64
GABRB3 known ✓ P28472 6/20 0.64
GABRB2 known ✓ P47870 5/20 0.64
GABRP known ✓ O00591 2/20 0.64
GABRD known ✓ O14764 2/20 0.64
GABRB1 known ✓ P18505 2/20 0.64
GABRA4 known ✓ P48169 2/20 0.64
GABRE known ✓ P78334 2/20 0.64
GABRA6 known ✓ Q16445 2/20 0.64
GABRG1 known ✓ Q8N1C3 2/20 0.64
GABRG3 known ✓ Q99928 2/20 0.64
GABRQ known ✓ Q9UN88 2/20 0.64
ADRA1A P35348 1/20 0.64
PDE4D Q08499 3/20 0.60
LMNA P02545 2/20 0.60
HPGD P15428 1/20 0.60

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
Clonazepam SCHEMBL14783900 0.96 GABRA1 (0.69) GABRA1GABRA5GABRA3GABRA2GABRG2
Clonazepam SCHEMBL17728660 0.84 GABRA1 (0.67) GABRA1GABRA5GABRA3GABRA2GABRG2
Flunitrazepam SCHEMBL8364961 0.80 GABRA1 (0.64) GABRA1GABRA5GABRA3GABRA2GABRG2
Clonazepam SCHEMBL20771795 0.80 GABRA1 (0.96) GABRA1GABRA5GABRA3GABRA2GABRG2
Clonazepam SCHEMBL13747803 0.80 GABRA1 (1.00) GABRA1GABRA5GABRA3GABRA2GABRG2
Clonazepam SCHEMBL38899 0.80 GABRA1 (1.00) GABRA1GABRA5GABRA3GABRA2GABRG2
Clonazepam SCHEMBL29369721 0.80 GABRA1 (1.00) GABRA1GABRA5GABRA3GABRA2GABRG2
Clonazepam SCHEMBL29361251 0.80 GABRA1 (1.00) GABRA1GABRA5GABRA3GABRA2GABRG2
Clonazepam SCHEMBL29743048 0.80 GABRA1 (1.00) GABRA1GABRA5GABRA3GABRA2GABRG2
Clonazepam SCHEMBL13746712 0.80 GABRA1 (1.00) GABRA1GABRA5GABRA3GABRA2GABRG2

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-1303280-A4 ENHANCED BRAIN FUNCTION BY GABA-ERGIC STIMULATION UNIV UTAH RES FOUND (US) 2005-09-21 EP claimed
EP-1303280-A1 ENHANCED BRAIN FUNCTION BY GABA-ERGIC STIMULATION University of Utah Research Foundation (US) 2003-04-23 EP claimed
WO-2002000221-A1 ENHANCED BRAIN FUNCTION BY GABA-ERGIC STIMULATION UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) 2002-01-03 WO claimed