SCHEMBL23620095

SCHEMBL23620095

Cc1ccnc(OC2CCC2)c1C(C)C

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 13/20 0.49
ACACB O00763 2/20 0.34
LOX P28300 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.33
ALOX5AP P20292 1/20 0.33
FEN1 P39748 1/20 0.33
GPR119 Q8TDV5 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33

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
SCHEMBL24713380 0.94 LRRK2 (0.41) LRRK2GPR119
SCHEMBL23620145 0.84 LRRK2 (0.46) LRRK2ACACBLOXLOXL2ALOX5AP
SCHEMBL25144091 0.78 LRRK2 (0.46) LRRK2ACACBLOXLOXL2
SCHEMBL23620142 0.78 LRRK2 (0.38) LRRK2IRAK4
SCHEMBL19443692 0.76 LRRK2 (0.55) LRRK2LOXLOXL2
SCHEMBL14853043 0.74 CCR1 (0.39) LRRK2
SCHEMBL24713250 0.74 LRRK2 (0.36) LRRK2ACACBALOX5APFEN1
SCHEMBL24713323 0.73 LRRK2 (0.35) LRRK2
SCHEMBL27340986 0.72 OPRL1 (0.33)
SCHEMBL25144094 0.72 LRRK2 (0.43) LRRK2ACACBLOXLOXL2ALOX5AP

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
EP-4079724-A1 FUSED RING COMPOUND AND APPLICATION THEREOF Wuhan LL Science and Technology Development Co., Ltd. (CN) 2022-10-26 EP disclosed
WO-2021136238-A1 FUSED RING COMPOUND AND APPLICATION THEREOF 武汉朗来科技发展有限公司 2021-07-08 WO disclosed