SCHEMBL22922396

SCHEMBL22922396

Cc1cc(-c2cnc3[nH]cc(-c4ccc(C(=O)N(C)C[C@@H]5CCOC5)cc4)c3n2)cc2c1N1CCN(C)C[C@@H]1CC2

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 10/20 0.61
CYP11B2 P19099 2/20 0.36
EGLN1 Q9GZT9 2/20 0.33
MAPK1 P28482 1/20 0.33
AXL P30530 1/20 0.32
MERTK Q12866 1/20 0.32
JAK2 O60674 2/20 0.32
JAK1 P23458 2/20 0.32
TYK2 P29597 2/20 0.32
JAK3 P52333 2/20 0.32
PIK3CG P48736 1/20 0.32
MAP3K11 Q16584 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
SCHEMBL22922395 1.00 MAP4K1 (0.61) MAP4K1CYP11B2EGLN1MAPK1AXL
SCHEMBL29869239 1.00 MAP4K1 (0.61) MAP4K1CYP11B2EGLN1MAPK1AXL
SCHEMBL29869467 1.00 MAP4K1 (0.61) MAP4K1CYP11B2EGLN1MAPK1AXL
SCHEMBL22922560 0.94 MAP4K1 (0.54) MAP4K1CYP11B2MAPK1JAK2JAK1
SCHEMBL22922544 0.94 MAP4K1 (0.54) MAP4K1CYP11B2MAPK1JAK2JAK1
SCHEMBL29868936 0.94 MAP4K1 (0.54) MAP4K1CYP11B2MAPK1JAK2JAK1
SCHEMBL29869147 0.94 MAP4K1 (0.54) MAP4K1CYP11B2MAPK1JAK2JAK1
SCHEMBL22922393 0.89 MAP4K1 (0.77) MAP4K1CYP11B2PIK3CGMAP3K11
SCHEMBL22922484 0.89 MAP4K1 (0.77) MAP4K1CYP11B2PIK3CGMAP3K11
SCHEMBL22922392 0.89 MAP4K1 (0.77) MAP4K1CYP11B2PIK3CGMAP3K11

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-112239473-B Process for preparing tricyclic compounds as HPK1 inhibitors 百济神州(北京)生物科技有限公司 2023-12-08 CN disclosed
CN-114127067-A Tricyclic compounds as HPK1 inhibitors and uses thereof 百济神州有限公司 2022-03-01 CN disclosed
WO-2021013083-A1 TRICYCLIC COMPOUNDS AS HPK1 INHIBITOR AND THE USE THEREOF BEIGENE, LTD. (KY) 2021-01-28 WO disclosed
CN-112239473-A Tricyclic compounds as HPK1 inhibitors 百济神州(北京)生物科技有限公司 2021-01-19 CN disclosed