SCHEMBL30065387

SCHEMBL30065387

CC1(C)OB(c2cccc3cc(F)ccc23)OC1(C)C

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LPL P06858 5/20 0.42
LIPG Q9Y5X9 5/20 0.42
JAK2 O60674 3/20 0.36
BTK Q06187 3/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2A6 P11509 1/20 0.36
IDO1 P14902 2/20 0.36
TDO2 P48775 1/20 0.35
CXCR2 P25025 3/20 0.32
ACHE P22303 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
SCHEMBL22555255 1.00 LPL (0.42) LPLLIPGJAK2BTKCYP1A2
SCHEMBL23043319 0.88 LPL (0.42) LPLLIPGJAK2BTKCYP1A2
SCHEMBL30876507 0.88 LPL (0.42) LPLLIPGJAK2BTKCYP1A2
SCHEMBL29634815 0.88 LPL (0.42) LPLLIPGJAK2BTKCYP1A2
SCHEMBL30065204 0.84 LPL (0.43) LPLLIPGJAK2BTKCYP1A2
SCHEMBL22555118 0.84 LPL (0.43) LPLLIPGJAK2BTKCYP1A2
SCHEMBL30369989 0.83 JAK2 (0.39) LPLLIPGJAK2BTK
SCHEMBL25177449 0.83 JAK2 (0.39) LPLLIPGJAK2BTK
SCHEMBL23043114 0.83 CYP1A2 (0.49) LPLLIPGJAK2BTKCYP1A2
SCHEMBL23569435 0.81 ESR1 (0.39) LPLLIPGJAK2BTKCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4511127-A1 KRAS G12D MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2025-02-26 EP disclosed
WO-2023205719-A1 KRAS G12D MODULATING COMPOUNDS GILEAD SCIENCES, INC. (US) 2023-10-26 WO disclosed
EP-4087573-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2022-11-16 EP disclosed