SCHEMBL9368596

SCHEMBL9368596

FC(F)(F)C(Cc1c[nH]cn1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.41
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32

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
Hydrochloric Acid SCHEMBL9719736 0.98 PARP1 (0.40) PARP1ESR1ESR2GRIN2DGRIN3B
SCHEMBL223841 0.84 SLC6A3 (0.33) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL9727813 0.80 SLC6A4 (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL10551331 0.76 MAOA (0.44) ESR1ESR2
SCHEMBL30280698 0.76 GRIN2D (0.57) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL11336356 0.76 LMNA (0.41)
SCHEMBL224227 0.73 TAAR1 (0.44) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL221821 0.73 CCR5 (0.38) ESR1ESR2GRIN2DGRIN3BGRIN1
SCHEMBL10456976 0.72 ESR1 (0.36) ESR1ESR2GRIN2DGRIN3BGRIN1
Oxalic Acid SCHEMBL5154647 0.71 KDM4E (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0486385-B1 Imidazole derivatives, process for their fabrication and pharmaceutical compositions containing them ADIR (FR) 1994-12-28 EP claimed
US-5173502-A For treating depression, hypertension, parkinson*s disease, asthma, convulasions, platelet aggregation of metabolic disorders ADIR ET COMPAGNIE (FR) 1992-12-22 US claimed
EP-0486385-A1 Imidazole derivatives, process for their fabrication and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1992-05-20 EP claimed
EP-0486385-B1 Imidazole derivatives, process for their fabrication and pharmaceutical compositions containing them ADIR (FR) 1994-12-28 EP disclosed
EP-0486385-A1 Imidazole derivatives, process for their fabrication and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1992-05-20 EP disclosed