SCHEMBL24823318

SCHEMBL24823318

CC(C)(O)c1nc2cc3c(cc2cc1N)OCC3

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 2/20 0.37
MAPT P10636 2/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PRKCI P41743 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
MAP3K14 Q99558 2/20 0.31
PIK3CD O00329 1/20 0.31
PIK3R1 P27986 1/20 0.31
PLAU P00749 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
SCHEMBL30310926 1.00 DYRK1A (0.37) DYRK1AMAPTRAB9ASMN1; SMN2PRKCI
SCHEMBL30310938 0.95 DYRK1A (0.37) DYRK1AMAPTRAB9ASMN1; SMN2PRKCI
SCHEMBL24823317 0.95 DYRK1A (0.37) DYRK1AMAPTRAB9ASMN1; SMN2PRKCI
SCHEMBL30952889 0.80 RAB9A (0.37) MAPTRAB9ASMN1; SMN2KDM4ENPC1
SCHEMBL23625903 0.80 RAB9A (0.37) MAPTRAB9ASMN1; SMN2KDM4ENPC1
SCHEMBL24823322 0.79 RXFP1 (0.38) MAPTKDM4E
SCHEMBL30311034 0.79 RXFP1 (0.38) MAPTKDM4E
SCHEMBL24823325 0.77
SCHEMBL30310958 0.77
SCHEMBL30148370 0.77 CYP11B1 (0.39) MAP3K14

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
CN-115843293-A Tricyclic compound, preparation method and medical application thereof 中国医药研究开发中心有限公司 2023-03-24 CN disclosed
WO-2022267930-A1 TRICYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 中国医药研究开发中心有限公司 2022-12-29 WO disclosed