SCHEMBL24619212

SCHEMBL24619212

Cc1cc(C(C)C)c2cc(B3OC(C)(C)C(C)(C)O3)cc(F)c2n1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LPL P06858 2/20 0.34
LIPG Q9Y5X9 2/20 0.34
IDO1 P14902 1/20 0.34
TDO2 P48775 1/20 0.34
EGFR P00533 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.31
AAK1 Q2M2I8 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
SCHEMBL29684289 1.00 LPL (0.34) LPLLIPGIDO1TDO2EGFR
SCHEMBL24619120 0.90 IDO1 (0.33) LPLLIPGIDO1TDO2EGFR
SCHEMBL30629479 0.82 FFAR1 (0.33) LPLLIPGEGFRAAK1
SCHEMBL24619603 0.78 PRMT5 (0.40) AAK1
SCHEMBL29727181 0.78 LPL (0.33) LPLLIPGIDO1TDO2EGFR
SCHEMBL24619233 0.78 LPL (0.33) LPLLIPGIDO1TDO2EGFR
SCHEMBL30629498 0.77 IDO1 (0.43) LPLLIPGIDO1TDO2EGFR
SCHEMBL24619125 0.77 IDO1 (0.33) LPLLIPGIDO1TDO2EGFR
SCHEMBL29684436 0.77 IDO1 (0.33) LPLLIPGIDO1TDO2EGFR
SCHEMBL24619696 0.77 KDM4E (0.36) IDO1TDO2EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022149057-A1 CDK INHIBITORS RHIZEN PHARMACEUTICALS AG (CH) 2022-07-14 WO disclosed