SCHEMBL8945834

SCHEMBL8945834

CNC(Cc1cc(Br)ccc1N)c1ccsc1C

nearest known ligand 0.70

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.30

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
SCHEMBL9425401 0.82 MAPT (0.30) MAPT
SCHEMBL8945781 0.81
Hydrochloric Acid SCHEMBL8945916 0.80 CYP3A4 (0.30)
SCHEMBL9583218 0.79 MAPT (0.34) MAPT
Hydrochloric Acid SCHEMBL9582726 0.78 MAPT (0.33) MAPT
SCHEMBL9425585 0.78 CYP3A4 (0.36)
Hydrochloric Acid SCHEMBL8945978 0.77 CYP3A4 (0.35) MAPT
SCHEMBL10475588 0.75 MAPT (0.35) MAPT
Hydrochloric Acid SCHEMBL9583459 0.74 MAPT (0.35) MAPT
SCHEMBL8945857 0.72 ALDH1A1 (0.32)

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
US-5292760-A 4-heteroaryl-1,3-benzodiazepines and 2-substituted-α-(heteroaryl)benzeneethanamines HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1994-03-08 US claimed
US-5510346-A ANTIDEPRESSANTS, ANTIANXIETY AGENTS HOECHST MARION ROUSSEL, INC. (US) 1996-04-23 US disclosed
US-5292760-A 4-heteroaryl-1,3-benzodiazepines and 2-substituted-α-(heteroaryl)benzeneethanamines HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1994-03-08 US disclosed
EP-0322582-A2 4-Heteroaryl-1,3-Benzodiazepines and 2-substituted-alpha-(heteroaryl)benzeneethanamines, a process for their preparation and their use us medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1989-07-05 EP disclosed