SCHEMBL8946162

SCHEMBL8946162

CCCC1=Nc2ccccc2CC(c2cn[nH]c2)N1C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.30
CTSD P07339 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
SCHEMBL8946195 0.91 HSD11B1 (0.31) HSD11B1
SCHEMBL8946028 0.82 HSD11B1 (0.33) HSD11B1CTSD
SCHEMBL8945861 0.78 SMN1; SMN2 (0.32) CTSD
SCHEMBL8945770 0.74 SLC6A2 (0.36)
SCHEMBL11270824 0.74 CHRNB2 (0.37)
Hydrochloric Acid SCHEMBL8945853 0.74 SLC6A2 (0.36)
SCHEMBL8945957 0.73 HTT (0.31) CTSD
Hydrochloric Acid SCHEMBL8945738 0.71 HTT (0.30)
SCHEMBL9583461 0.71 MAOA (0.40)
SCHEMBL8946144 0.71 CYP19A1 (0.34)

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-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