SCHEMBL15088392

SCHEMBL15088392

[O-][S+]1CCc2[nH]nc(NC3CCOCC3)c21

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 5/20 0.37
▸ MAPK1 P28482 3/20 0.33
▸ MAPK14 Q16539 1/20 0.32
▸ JAK2 O60674 1/20 0.32
▸ JAK1 P23458 1/20 0.32
▸ CSF1R P07333 1/20 0.30

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
SCHEMBL15088395 1.00 LRRK2 (0.37) LRRK2MAPK1MAPK14JAK2JAK1
SCHEMBL15088431 1.00 LRRK2 (0.37) LRRK2MAPK1MAPK14JAK2JAK1
SCHEMBL15088466 0.71 LRRK2 (0.43) LRRK2MAPK1MAPK14JAK2JAK1
SCHEMBL10283145 0.70 PIK3CA (0.36) LRRK2MAPK1
SCHEMBL20840622 0.70 MAPK1 (0.35) MAPK1
SCHEMBL516176 0.70 MAPK1 (0.35) MAPK1
SCHEMBL20851935 0.70 MAPK1 (0.35) MAPK1
SCHEMBL8061460 0.70 KCNH2 (0.36) MAPK1
SCHEMBL16503391 0.69 MAPK1 (0.37) LRRK2MAPK1CSF1R
SCHEMBL26980840 0.65 PDE4D (0.39) MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2610258-A1 Substituted piperidino dihydrothieno pyrimidines BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-07-03 — — EP disclosed
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