SCHEMBL24722210

SCHEMBL24722210

COc1cc(C)cc(OC)c1-c1ccc(Cl)cc1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
PTGS2 P35354 3/20 0.39
ACHE P22303 2/20 0.38
AMY1A P0DUB6 1/20 0.38
PTGS1 P23219 1/20 0.38
THRB P10828 1/20 0.37
HPGD P15428 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
CTSA P10619 1/20 0.37
MAPT P10636 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
TRPV4 Q9HBA0 1/20 0.37
EGFR P00533 1/20 0.36
FGFR1 P11362 1/20 0.36
FLT1 P17948 1/20 0.36
EPHB2 P29323 1/20 0.36

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
SCHEMBL21108850 0.85 TGFBR1 (0.42) HSP90AA1HSP90AB1PTGS2AMY1APTGS1
SCHEMBL20209151 0.80 LMNA (0.40) HSP90AA1PTGS2AMY1APTGS1CTSA
SCHEMBL20209464 0.79 HSP90AA1 (0.43) HSP90AA1HSP90AB1AMY1ACTSAKMT2A
SCHEMBL22737966 0.79 HSP90AA1 (0.46) HSP90AA1HSP90AB1AMY1ACTSAKMT2A
SCHEMBL21450434 0.78 AMY1A (0.39) HSP90AA1HSP90AB1PTGS2AMY1APTGS1
SCHEMBL22375222 0.75 HSP90AA1 (0.46) HSP90AA1HSP90AB1PTGS2AMY1ACTSA
SCHEMBL30081136 0.75 HSP90AA1 (0.43) HSP90AA1HSP90AB1AMY1AKMT2ALMNA
SCHEMBL23327833 0.75 HSP90AA1 (0.43) HSP90AA1HSP90AB1AMY1AKMT2ALMNA
SCHEMBL20502887 0.75 HSP90AA1 (0.43) HSP90AA1HSP90AB1AMY1AKMT2ALMNA
SCHEMBL30081126 0.75 HSP90AA1 (0.43) HSP90AA1HSP90AB1AMY1AKMT2ALMNA

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
US-20220399508-A1 COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2022-12-15 US disclosed