SCHEMBL2647150

SCHEMBL2647150

Nc1ccc2c(c1)ncn2-c1cccc(-c2cccnc2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 6/20 0.60
GABRA1 P14867 1/20 0.58
GABRG2 P18507 1/20 0.58
GABRB3 P28472 1/20 0.58
GABRA5 P31644 1/20 0.58
GABRA3 P34903 1/20 0.58
GABRA2 P47869 1/20 0.58
MEN1 O00255 1/20 0.52
PSIP1 O75475 1/20 0.52
AXL P30530 1/20 0.52
MKNK1 Q9BUB5 1/20 0.52
MKNK2 Q9HBH9 1/20 0.52
MAPT P10636 3/20 0.48
ALDH1A1 P00352 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
DHFR P00374 1/20 0.44
HTT P42858 1/20 0.42
KDR P35968 1/20 0.41
F9 P00740 1/20 0.40
F10 P00742 1/20 0.40

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
SCHEMBL2643550 0.85 FGFR1 (0.78) FGFR1MAPTALDH1A1SMN1; SMN2HTT
SCHEMBL2646283 0.85 GABRA1 (0.58) FGFR1GABRA1GABRG2GABRB3GABRA5
SCHEMBL2656285 0.85 GABRA1 (0.58) FGFR1GABRA1GABRG2GABRB3GABRA5
SCHEMBL2652116 0.84 GABRA1 (0.57) FGFR1GABRA1GABRG2GABRB3GABRA5
Hydrochloric Acid SCHEMBL2642014 0.84 FGFR1 (0.76) FGFR1MAPTALDH1A1SMN1; SMN2HTT
SCHEMBL13045092 0.84 FGFR1 (0.57) FGFR1GABRA1GABRG2GABRB3GABRA5
SCHEMBL2646874 0.84 GABRA1 (0.57) FGFR1GABRA1GABRG2GABRB3GABRA5
SCHEMBL2652596 0.82 GABRA1 (0.56) FGFR1GABRA1GABRG2GABRB3GABRA5
SCHEMBL2651965 0.82 GABRA1 (0.56) FGFR1GABRA1GABRG2GABRB3GABRA5
SCHEMBL2651085 0.82 GABRA1 (0.56) FGFR1GABRA1GABRG2GABRB3GABRA5

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
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