SCHEMBL24072279

SCHEMBL24072279

CNc1cnc(NC(=O)c2ccc(N3CCN(C)CC3)cc2C)s1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 10/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ LCK P06239 5/20 0.43
▸ RAB9A P51151 4/20 0.43
▸ NPC1 O15118 3/20 0.43
▸ KDR P35968 5/20 0.43
▸ AURKA O14965 1/20 0.43
▸ FLT3 P36888 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ GLA P06280 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ MCL1 Q07820 1/20 0.42
▸ LRRK2 Q5S007 2/20 0.41
▸ MAP3K7 O43318 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
SCHEMBL24074432 0.86 MAPK14 (0.49) MAPK14L3MBTL1LCKRAB9ANPC1
SCHEMBL24074689 0.84 MAPK14 (0.48) MAPK14L3MBTL1LCKRAB9ANPC1
SCHEMBL25063113 0.83 STAT3 (0.58) MAPK14L3MBTL1RAB9ANPC1ALDH1A1
SCHEMBL24074435 0.80 STAT3 (0.51) LCKRAB9ANPC1KDM4EALDH1A1
SCHEMBL24073697 0.79 ADORA2A (0.45) RAB9ANPC1ALDH1A1KMT2A
SCHEMBL24074056 0.78 NPC1 (0.46) RAB9ANPC1KDM4EALDH1A1KMT2A
SCHEMBL24072436 0.76 POLQ (0.41) MAPK14LCKRAB9ANPC1KDM4E
SCHEMBL24072281 0.75 LRRK2 (0.48) RAB9AKDM4EALDH1A1GLAMAPT
SCHEMBL24074387 0.73 MAPT (0.48) RAB9AKDM4EALDH1A1GLAMAPT
SCHEMBL24073694 0.73 STAT3 (0.51) RAB9ANPC1KDM4EALDH1A1MAPT

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
WO-2021239117-A1 MODIFIED PROTEINS AND PROTEIN DEGRADERS CULLGEN (SHANGHAI) , INC. (CN) 2021-12-02 — — WO disclosed
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