SCHEMBL17423737

SCHEMBL17423737

O=C(O)c1n[nH]c2cc(Oc3cccnc3)ccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ EGLN2 Q96KS0 2/20 0.44
▸ EGLN1 Q9GZT9 2/20 0.44
▸ METAP2 P50579 1/20 0.44
▸ PRKAG1 P54619 4/20 0.43
▸ PRKAA1 Q13131 4/20 0.43
▸ PRKAB1 Q9Y478 4/20 0.43
▸ KDR P35968 4/20 0.43
▸ CHEK1 O14757 3/20 0.43
▸ FGFR1 P11362 2/20 0.43
▸ DRD2 P14416 1/20 0.43
▸ DRD3 P35462 1/20 0.43
▸ PRKAB2 O43741 3/20 0.42
▸ PRKAA2 P54646 3/20 0.42
▸ PRKAG3 Q9UGI9 3/20 0.42
▸ PRKAG2 Q9UGJ0 3/20 0.42
▸ CYP19A1 P11511 2/20 0.42
▸ HAO1 Q9UJM8 1/20 0.42
▸ LCK P06239 1/20 0.41

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
SCHEMBL17423747 0.89 LMNA (0.47) LMNATDP1EGLN2EGLN1METAP2
SCHEMBL17423759 0.87 KDM4E (0.53) LMNATDP1EGLN2EGLN1METAP2
SCHEMBL17432054 0.86 LMNA (0.43) LMNATDP1EGLN2EGLN1METAP2
Bromide SCHEMBL17423756 0.85 LMNA (0.43) LMNATDP1EGLN2EGLN1METAP2
SCHEMBL26980051 0.84 PRKAG1 (0.47) PRKAG1PRKAA1PRKAB1KDRCHEK1
SCHEMBL29644268 0.84 PRKAG1 (0.47) PRKAG1PRKAA1PRKAB1KDRCHEK1
SCHEMBL17423828 0.83 METAP2 (0.42) LMNATDP1EGLN2EGLN1METAP2
SCHEMBL17423781 0.79 LMNA (0.53) LMNATDP1METAP2KDRCHEK1
SCHEMBL176882 0.76 PRKAG1 (0.66) TDP1PRKAG1PRKAA1PRKAB1PRKAB2
SCHEMBL17597511 0.74 DRD2 (0.38) TDP1EGLN2EGLN1METAP2DRD2

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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