SCHEMBL18217189

SCHEMBL18217189

CCCCCC(CC)Cc1ccc(-c2ccc(-c3c4nccnc4c(-c4ccc(-c5ccc(CC(CC)CCCCC)cc5)s4)c4nsnc34)s2)cc1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ BDKRB2 P30411 3/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL20176728 0.87 SMN1; SMN2 (0.32) BDKRB2SMN1; SMN2
SCHEMBL20176730 0.86 KDM4E (0.31) —
SCHEMBL20176716 0.85 SMN1; SMN2 (0.32) BDKRB2SMN1; SMN2
SCHEMBL18217182 0.84 SMN1; SMN2 (0.32) BDKRB2SMN1; SMN2
SCHEMBL20176726 0.84 — —
SCHEMBL20176727 0.83 RAB9A (0.42) SMN1; SMN2
SCHEMBL21019972 0.83 SMN1; SMN2 (0.32) BDKRB2SMN1; SMN2
SCHEMBL20176731 0.83 GLA (0.31) —
SCHEMBL18418550 0.81 BDKRB2 (0.38) BDKRB2SMN1; SMN2
SCHEMBL20182413 0.81 SMN1; SMN2 (0.30) SMN1; SMN2

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
US-10738240-B2 Thiadiazoloquinoxaline derivatives MERCK PATENT GMBH (DE) 2020-08-11 — — US disclosed
US-20180142153-A1 THIADIAZOLOQUINOXALINE DERIVATIVES MERCK PATENT GMBH (DE) 2018-05-24 — — US disclosed
US-20180142153-A1 THIADIAZOLOQUINOXALINE DERIVATIVES MERCK PATENT GMBH (DE) 2018-05-24 — — US disclosed
WO-2016177449-A1 THIADIAZOLOQUINOXALINE DERIVATIVES MERCK PATENT GMBH (DE) 2016-11-10 — — WO disclosed
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