SCHEMBL28333328

SCHEMBL28333328

CC(Cc1ccccc1)NC(=O)c1nc2cc3c(-c4ccncc4)n[nH]c3cc2[nH]1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 13/20 0.49
MAPK3 P27361 6/20 0.47
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
DYRK1A Q13627 1/20 0.40
CYP3A4 P08684 1/20 0.39
PTGFR P43088 1/20 0.39

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
SCHEMBL22497617 1.00 MAPK1 (0.49) MAPK1MAPK3MEN1NPC1RAB9A
SCHEMBL28335674 0.88 MAPK1 (0.53) MAPK1MAPK3
SCHEMBL28335678 0.88 MAPK1 (0.53) MAPK1MAPK3
SCHEMBL20916811 0.86 MAPK1 (0.53) MAPK1MAPK3CYP3A4
SCHEMBL20916856 0.86 MAPK1 (0.53) MAPK1MAPK3CYP3A4
SCHEMBL20931371 0.86 MAPK1 (0.53) MAPK1MAPK3CYP3A4
SCHEMBL30554347 0.86 MAPK1 (0.53) MAPK1MAPK3CYP3A4
SCHEMBL30554352 0.86 MAPK1 (0.53) MAPK1MAPK3CYP3A4
SCHEMBL20931540 0.85 MAPK1 (0.47) MAPK1MAPK3
SCHEMBL20931539 0.85 MAPK1 (0.47) MAPK1MAPK3

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
CN-112020357-B Salt of indazolyl-containing tricyclic derivative and crystal form thereof 上海翰森生物医药科技有限公司 2023-08-29 CN disclosed
CN-110546150-B Pyrazolyl-containing tricyclic derivatives, preparation method and application thereof 江苏豪森药业集团有限公司 2021-12-21 CN disclosed
CN-112020357-A Salts of indazolyl-containing tricyclic derivatives and crystal forms thereof 上海翰森生物医药科技有限公司 2020-12-01 CN disclosed
CN-110546150-A Pyrazolyl-containing tricyclic derivatives, preparation method and application thereof JIANGSU HANSOH PHARMACEUTICAL GROUP CO LTD 2019-12-06 CN disclosed