SCHEMBL2641999

SCHEMBL2641999

CC(C)OC(=O)c1ccc2c(c1)ncn2-c1cccc(-c2ccccc2)c1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 5/20 0.64
PDCD1 Q15116 1/20 0.51
CD274 Q9NZQ7 1/20 0.51
HPGD P15428 8/20 0.50
KDR P35968 1/20 0.50
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
GABRA1 P14867 1/20 0.48
GABRG2 P18507 1/20 0.48
GABRB3 P28472 1/20 0.48
GABRA5 P31644 1/20 0.48
GABRA3 P34903 1/20 0.48
GABRA2 P47869 1/20 0.48
ALDH1A1 P00352 1/20 0.47
GLA P06280 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL2648342 0.85 FGFR1 (0.59) FGFR1HPGDNPC1RAB9AMEN1
SCHEMBL1762218 0.84 FGFR1 (0.50) FGFR1HPGDGABRA1GABRG2GABRB3
SCHEMBL2943514 0.83 HPGD (0.58) FGFR1HPGDNPC1RAB9AALDH1A1
SCHEMBL2337170 0.82 FGFR1 (0.60) FGFR1HPGDNPC1RAB9AKMT2A
SCHEMBL2940112 0.82 HPGD (0.60) FGFR1HPGDNPC1RAB9AALDH1A1
SCHEMBL2944419 0.81 HPGD (0.58) FGFR1HPGDNPC1RAB9AALDH1A1
SCHEMBL6752853 0.80 HPGD (0.59) FGFR1HPGDNPC1RAB9AALDH1A1
SCHEMBL2570944 0.78 FGFR1 (1.00) FGFR1HPGDKDRNPC1RAB9A
SCHEMBL2648630 0.78 FGFR1 (0.56) FGFR1HPGDKDRNPC1RAB9A
SCHEMBL30158779 0.78 FGFR1 (0.55) FGFR1PDCD1CD274HPGDNPC1

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
EP-0563001-B1 Imidazole compounds, their preparation and use NEUROSEARCH AS (DK) 1996-02-28 EP disclosed
US-5360809-A Imidazole compounds and their use as calcium channel blockers NEUROSEARCH A/S (DK) 1994-11-01 US disclosed
EP-0563001-A1 Imidazole compounds, their preparation and use NEUROSEARCH A/S (DK) 1993-09-29 EP disclosed