SCHEMBL27345685

SCHEMBL27345685

COc1cc(B2OC(C)(C)C(C)(C)O2)ccc1OCc1ccc(OC(F)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 4/20 0.46
EGFR P00533 1/20 0.45
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
DGAT1 O75907 1/20 0.40
HIF1A Q16665 1/20 0.37
LPL P06858 4/20 0.36
LIPG Q9Y5X9 4/20 0.36
SNCA P37840 1/20 0.36
PPARG P37231 1/20 0.36
KIT P10721 1/20 0.36
NTRK1 P04629 1/20 0.35
NTRK3 Q16288 1/20 0.35
NTRK2 Q16620 1/20 0.35
MRGPRX4 Q96LA9 1/20 0.35
ADAMTS5 Q9UNA0 1/20 0.35
MAPK1 P28482 1/20 0.34

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
SCHEMBL1516719 0.88 EGFR (0.48) CSF1REGFRMAPTDGAT1HIF1A
SCHEMBL31034717 0.86 EGFR (0.46) CSF1REGFRLMNAMAPTDGAT1
SCHEMBL27345509 0.86 EGFR (0.46) CSF1REGFRLMNAMAPTDGAT1
SCHEMBL27345601 0.85 EGFR (0.48) CSF1REGFRLMNAMAPTDGAT1
SCHEMBL25179630 0.85 DGAT1 (0.46) CSF1REGFRDGAT1HIF1ALPL
SCHEMBL29362049 0.85 DGAT1 (0.46) CSF1REGFRDGAT1HIF1ALPL
SCHEMBL27345600 0.84 EGFR (0.45) CSF1REGFRMAPTDGAT1HIF1A
SCHEMBL27345419 0.84 HIF1A (0.39) CSF1REGFRLMNAMAPTDGAT1
SCHEMBL27345779 0.83 EGFR (0.48) CSF1REGFRLMNAMAPTDGAT1
SCHEMBL17129078 0.83 DGAT1 (0.52) DGAT1HIF1ALPLLIPGMRGPRX4

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-2024133605-A1 SUBSTITUTED 3,7-DIHYDRO-1 H-PURINE-2,6-DIONES AND USE THEREOF INVIOS GMBH (AT) 2024-06-27 WO disclosed