SCHEMBL8274469

SCHEMBL8274469

Cc1nnc2n1-c1ccccc1C(c1ccccc1Cl)=NC2

nearest known ligand 0.80

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 5/20 0.80
GABRA5 P31644 5/20 0.80
GABRA2 P47869 5/20 0.80
GABRA3 P34903 4/20 0.80
OPRK1 P41145 3/20 0.80
PDE4D Q08499 2/20 0.80
GABRG2 P18507 1/20 0.80
HTR2A P28223 1/20 0.80
GABRB3 P28472 1/20 0.80
ADRA1A P35348 1/20 0.80
PTAFR P25105 10/20 0.76
GABRB2 P47870 4/20 0.76
TSHR P16473 1/20 0.76
BRD4 O60885 2/20 0.73
HPGD P15428 2/20 0.63
SMN1; SMN2 Q16637 1/20 0.63
LMNA P02545 1/20 0.59
CNR1 P21554 1/20 0.59
TDP1 Q9NUW8 1/20 0.57

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
Triazolam SCHEMBL29228 0.89 GABRA1 (1.00) GABRA1GABRA5GABRA2GABRA3OPRK1
Triazolam SCHEMBL5142333 0.89 GABRA1 (1.00) GABRA1GABRA5GABRA2GABRA3OPRK1
Triazolam SCHEMBL29382425 0.89 GABRA1 (1.00) GABRA1GABRA5GABRA2GABRA3OPRK1
Triazolam SCHEMBL29368430 0.89 GABRA1 (1.00) GABRA1GABRA5GABRA2GABRA3OPRK1
Triazolam SCHEMBL29349744 0.89 GABRA1 (1.00) GABRA1GABRA5GABRA2GABRA3OPRK1
SCHEMBL13352295 0.89 GABRA1 (0.83) GABRA1GABRA5GABRA2GABRA3OPRK1
SCHEMBL11618597 0.88 GABRA1 (0.67) GABRA1GABRA5GABRA2GABRA3OPRK1
Triazolam SCHEMBL27600059 0.88 GABRA1 (0.98) GABRA1GABRA5GABRA2GABRA3OPRK1
Triazolam SCHEMBL9055695 0.88 GABRA1 (0.98) GABRA1GABRA5GABRA2GABRA3OPRK1
SCHEMBL14497013 0.87 GABRA1 (0.79) GABRA1GABRA5GABRA2GABRA3OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7618958-B2 Convulsant disorders having the side effects of reduced alcohol craving in human alcoholics and a concomitant reduced sedative, hypnosis; Ethyl 8-bromo-6-phenyl-4H-benzo[f]imidazo[1,5-a][1,4]diazepine-3-carboxylate WISYS TECHNOLOGY FOUNDATION, INC. (US) 2009-11-17 US disclosed
US-20080108605-A1 ANXIOLYTIC AGENTS WITH REDUCED SEDATIVE AND ATAXIC EFFECTS WISYS TECHNOLOGY FOUNDATION, INC. (US) 2008-05-08 US disclosed
US-7235656-B2 Anxiolytic agents with reduced sedative and ataxic effects WISYS TECHNOLOGY FOUNDATION, INC. (US) 2007-06-26 US disclosed
US-20070054881-A1 Orally active benzodiazepine derivatives and their salts; anticonvulsants with reduced hypnotic and muscle relaxant side effects; eating and psychological disorders WISYS TECHNOLOGY FOUNDATION, INC. (US) 2007-03-08 US disclosed
WO-2006004945-A1 STEREOSPECIFIC ANXIOLYTIC AND ANTICONVULSANT AGENTS WITH REDUCED MUSCLE-RELAXANT, SEDATIVE-HYPNOTIC AND ATAXIC EFFECTS WISYS TECHNOLOGY FOUNDATION, INC. (US) 2006-01-12 WO disclosed
WO-2003082832-A2 ANXIOLYTIC AGENTS WITH REDUCED SEDATIVE AND ATAXIC EFFECTS WISYS TECHNOLOGY FOUNDATION, INC. (US) 2003-10-09 WO disclosed
US-4018788-A 6-(O-Halophenyl)-1-methyl-4H-s-triazolo[4,3-a][1,4]-benzodiazepine THE UPJOHN COMPANY (US) 1977-04-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080108605-A1 ANXIOLYTIC AGENTS WITH REDUCED SEDATIVE AND ATAXIC EFFECTS GABRA3, GABRA2, GABRA1 GABRA1 3/4885GABRA5 6/4885GABRA2 2/4885
US-20070054881-A1 Orally active benzodiazepine derivatives and their salts; anticonvulsants with reduced hypnotic and muscle relaxant side effects; eating and psychological disorders GABRA3, GABRA6, GABRA4 GABRA1 5/4885GABRA5 6/4885GABRA2 4/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.