SCHEMBL10929161

SCHEMBL10929161

CCOC(=O)c1cn(C2CC2)c2nc(S(=O)(=O)C(=O)c3ccc(C)cc3)c(F)cc2c1=O

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 1/20 0.45
▸ KDM4E B2RXH2 3/20 0.40
▸ HSD17B10 Q99714 3/20 0.40
▸ ABCC4 O15439 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ DPP4 P27487 6/20 0.40
▸ TOP2A P11388 3/20 0.40
▸ TOP2B Q02880 3/20 0.40
▸ CHRM2 P08172 1/20 0.40
▸ DRD1 P21728 1/20 0.40
▸ KMT2A Q03164 1/20 0.38
▸ HPGD P15428 3/20 0.38
▸ ALDH1A1 P00352 2/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ ELANE P08246 1/20 0.36

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
SCHEMBL10654948 0.89 ADRB2 (0.46) ADRB2KDM4EHSD17B10ABCC4LMNA
SCHEMBL5809336 0.81 ADRB2 (0.53) ADRB2KDM4EHSD17B10ABCC4LMNA
SCHEMBL10651097 0.81 ADRB2 (0.46) ADRB2KDM4EHSD17B10ABCC4LMNA
SCHEMBL5422476 0.80 ADRB2 (0.51) ADRB2KDM4EHSD17B10ABCC4LMNA
SCHEMBL10412649 0.77 ADRB2 (0.49) ADRB2KDM4EHSD17B10ABCC4LMNA
SCHEMBL10472546 0.77 ADRB2 (0.49) ADRB2KDM4EHSD17B10ABCC4LMNA
SCHEMBL8942057 0.77 ADRB2 (0.49) ADRB2KDM4EHSD17B10ABCC4LMNA
SCHEMBL9757281 0.77 DPP4 (0.51) ADRB2KDM4EHSD17B10ABCC4LMNA
SCHEMBL7005348 0.76 HPGD (0.41) ADRB2KDM4EHSD17B10ABCC4LMNA
SCHEMBL7230077 0.76 ADRB2 (0.50) ADRB2KDM4EHSD17B10ABCC4LMNA

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
JP-60032790-A — — None — — JP disclosed
JP-60028978-A — — None — — JP disclosed
JP-S6032790-A 1,8-NAPHTHYRIDINES DAINIPPON PHARMACEUT CO LTD 1985-02-19 — — JP disclosed
JP-S6028978-A 1,8-NAPHTHYRIDINE DERIVATIVE DAINIPPON PHARMACEUT CO LTD 1985-02-14 — — JP disclosed
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