SCHEMBL17423783

SCHEMBL17423783

c1cncc(Oc2ccc3cn[nH]c3c2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 3/20 0.57
▸ LMNA P02545 1/20 0.57
▸ TDP1 Q9NUW8 1/20 0.57
▸ LTA4H P09960 2/20 0.51
▸ CYP19A1 P11511 3/20 0.49
▸ METAP2 P50579 3/20 0.45
▸ DYRK1A Q13627 3/20 0.44
▸ CDK2 P24941 1/20 0.44
▸ CLK1 P49759 1/20 0.44
▸ CLK4 Q9HAZ1 1/20 0.44
▸ PIM1 P11309 1/20 0.44
▸ PIM3 Q86V86 1/20 0.44
▸ PIM2 Q9P1W9 1/20 0.44
▸ KDR P35968 1/20 0.44
▸ FGFR2 P21802 1/20 0.44
▸ FGFR3 P22607 1/20 0.44
▸ NOS1 P29475 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ MAPT P10636 1/20 0.44

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
SCHEMBL13923957 0.84 FGFR1 (0.57) FGFR1LTA4HMETAP2DYRK1ACDK2
SCHEMBL29644366 0.83 NOS1 (0.47) FGFR1LMNAMETAP2DYRK1ACDK2
SCHEMBL26979386 0.83 NOS1 (0.47) FGFR1LMNAMETAP2DYRK1ACDK2
SCHEMBL17423777 0.80 LMNA (0.59) LMNATDP1LTA4HCYP19A1MEN1
SCHEMBL2933092 0.75 NR4A1 (0.55) FGFR1LMNATDP1METAP2DYRK1A
SCHEMBL16114401 0.74 LMNA (0.75) LMNATDP1LTA4HCYP19A1HTT
SCHEMBL30535283 0.74 LMNA (0.82) LMNATDP1LTA4HCYP19A1HTT
SCHEMBL676142 0.74 LMNA (0.82) LMNATDP1LTA4HCYP19A1HTT
SCHEMBL2540132 0.74 LMNA (0.59) LMNATDP1LTA4HCYP19A1HTT
SCHEMBL17423760 0.74 LMNA (0.54) LMNATDP1LTA4HCYP19A1METAP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016007837-A1 CARBONYL LINKED BICYCLIC HETEROARYL ANTIBIOTIC TOLERANCE INHIBITORS SPERO THERAPEUTICS, INC. (US) 2016-01-14 — — WO disclosed
WO-2016007837-A1 CARBONYL LINKED BICYCLIC HETEROARYL ANTIBIOTIC TOLERANCE INHIBITORS SPERO THERAPEUTICS, INC. (US) 2016-01-14 — — WO disclosed
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