SCHEMBL2646769

SCHEMBL2646769

FC(F)(F)c1ccc2c(c1)ncn2-c1cccc(-n2cnc3ccccc32)c1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.59
FGFR1 P11362 10/20 0.57
AURKA O14965 1/20 0.56
KDR P35968 1/20 0.56
AURKB Q96GD4 1/20 0.56
ALDH1A1 P00352 1/20 0.53
HPGD P15428 1/20 0.53

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
SCHEMBL19915930 0.90 FGFR1 (0.62) HTTFGFR1KDRALDH1A1
SCHEMBL2642011 0.88 HPGD (0.52) HTTFGFR1AURKAKDRAURKB
SCHEMBL2666380 0.85 HPGD (0.52) HTTFGFR1AURKAKDRAURKB
SCHEMBL2642078 0.85 FGFR1 (0.63) FGFR1AURKAKDRAURKBALDH1A1
SCHEMBL2641974 0.85 HTT (0.58) HTTFGFR1AURKAKDRAURKB
SCHEMBL12138910 0.84 HTT (0.64) HTTFGFR1AURKAKDRAURKB
SCHEMBL30723122 0.84 HTT (0.68) HTTFGFR1AURKAKDRAURKB
SCHEMBL29145142 0.84 HTT (0.68) HTTFGFR1AURKAKDRAURKB
SCHEMBL3417304 0.83 HTT (0.78) HTTFGFR1
SCHEMBL1356729 0.83 FGFR1 (0.66) FGFR1AURKAKDRAURKBALDH1A1

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
EP-0616807-B1 Benzimidazole useful in the treatment of central nervous system disorders NEUROSEARCH AS (DK) 1998-07-08 EP claimed
US-5554630-A TREATING ANXIETY, CONVULSIONS AND SLEEP DISORDERS IN LIVING ANIMALS BY MODULATION OF THE BENZODIAZEPINE RECEPTOR OF THE CENTRAL NERVOUS SYSTEM WITH 1-/3-HETEROCYCLYLPHENYL/-BENZIMIDAZOLES NEUROSEARCH A/S (DK) 1996-09-10 US claimed
EP-0616807-A1 Benzimidazole useful in the treatment of central nervous system disorders NEUROSEARCH A/S (DK) 1994-09-28 EP claimed
EP-0616807-B1 Benzimidazole useful in the treatment of central nervous system disorders NEUROSEARCH AS (DK) 1998-07-08 EP disclosed
US-5554632-A CENTRAL NERVOUS SYSTEM NEUROSEARCH A/S (DK) 1996-09-10 US disclosed
US-5554630-A TREATING ANXIETY, CONVULSIONS AND SLEEP DISORDERS IN LIVING ANIMALS BY MODULATION OF THE BENZODIAZEPINE RECEPTOR OF THE CENTRAL NERVOUS SYSTEM WITH 1-/3-HETEROCYCLYLPHENYL/-BENZIMIDAZOLES NEUROSEARCH A/S (DK) 1996-09-10 US disclosed
EP-0616807-A1 Benzimidazole useful in the treatment of central nervous system disorders NEUROSEARCH A/S (DK) 1994-09-28 EP disclosed