SCHEMBL23043322

SCHEMBL23043322

CC1(C)OB(c2cccc3cccc(C(F)(F)F)c23)OC1(C)C

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LPL P06858 6/20 0.36
LIPG Q9Y5X9 6/20 0.36
LIPE Q05469 6/20 0.34
F2 P00734 2/20 0.33
F11 P03951 2/20 0.33
PRSS1 P07477 2/20 0.33
PRSS2 P07478 2/20 0.33
PRSS3 P35030 2/20 0.33
APAF1 O14727 1/20 0.33
USP2 O75604 1/20 0.33
PLCG1 P19174 1/20 0.33
CCR6 P51684 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
JAK2 O60674 2/20 0.32
BTK Q06187 2/20 0.32
PDK2 Q15119 1/20 0.30
RAD52 P43351 1/20 0.30

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
SCHEMBL29418644 1.00 LPL (0.36) LPLLIPGLIPEF2F11
SCHEMBL26708973 0.84 LPL (0.35) LPLLIPGLIPEF2F11
SCHEMBL4879042 0.83 LPL (0.39) LPLLIPGLIPEF2F11
SCHEMBL31440036 0.83 LPL (0.39) LPLLIPGLIPEF2F11
SCHEMBL29382961 0.81 LPL (0.43) LPLLIPGLIPEF2F11
SCHEMBL9755 0.81 LPL (0.43) LPLLIPGLIPEF2F11
SCHEMBL17315234 0.80 JAK2 (0.41) LPLLIPGLIPEF2F11
SCHEMBL29418721 0.80 JAK2 (0.41) LPLLIPGF11JAK2BTK
SCHEMBL23043006 0.80 JAK2 (0.41) LPLLIPGF11JAK2BTK
SCHEMBL13601624 0.80 LPL (0.37) LPLLIPGLIPEF2F11

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114615981-B KRAS G12D inhibitors 米拉蒂治疗股份有限公司 2024-04-12 CN disclosed
CN-116829151-A Azaquinazoline pan KRAS inhibitors 米拉蒂治疗股份有限公司 2023-09-29 CN disclosed
EP-4192585-A1 KRAS G12D INHIBITORS Mirati Therapeutics, Inc. (US) 2023-06-14 EP disclosed
EP-4021444-A1 KRAS G12D INHIBITORS Mirati Therapeutics, Inc. (US) 2022-07-06 EP disclosed
CN-114615981-A KRAS G12D inhibitors 米拉蒂治疗股份有限公司 2022-06-10 CN disclosed
WO-2021041671-A1 KRAS G12D INHIBITORS Mirati Therapeutics, Inc. (US) 2021-03-04 WO disclosed