SCHEMBL25763768

SCHEMBL25763768

COc1cccc(-c2cnc(C(C)C)c(C(F)(F)F)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 1/20 0.53
▸ AR P10275 1/20 0.53
▸ PDGFRB P09619 1/20 0.48
▸ PDGFRA P16234 1/20 0.48
▸ AKR1C4 P17516 1/20 0.46
▸ AKR1C3 P42330 1/20 0.46
▸ AKR1C2 P52895 1/20 0.46
▸ AKR1C1 Q04828 1/20 0.46
▸ CA12 O43570 1/20 0.45
▸ CA9 Q16790 1/20 0.45
▸ CYP11B1 P15538 2/20 0.45
▸ CYP11B2 P19099 2/20 0.45
▸ FYN P06241 3/20 0.44
▸ DYRK1A Q13627 1/20 0.44
▸ CLK4 Q9HAZ1 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ GLA P06280 1/20 0.44
▸ GAA P10253 1/20 0.44
▸ SYK P43405 1/20 0.44

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
SCHEMBL25763769 0.88 KCNH2 (0.48) PGRARDYRK1ANR1H2NR1H3
SCHEMBL25763766 0.85 CYP11B2 (0.52) PDGFRBPDGFRACYP11B2FYNALDH1A1
SCHEMBL25764075 0.83 AR (0.49) ARCYP11B2ALDH1A1GAAHPGD
SCHEMBL25764079 0.83 ESR1 (0.39) ARAKR1C3AKR1C2CYP11B2NPC1
SCHEMBL25764072 0.82 MAP4K4 (0.40) PGRCYP11B2KDM4EALDH1A1GLA
SCHEMBL25764706 0.82 PDGFRB (0.51) PDGFRBPDGFRAAKR1C3AKR1C2CA12
SCHEMBL25763772 0.80 FYN (0.43) CYP11B2FYNALDH1A1GAASYK
SCHEMBL25763798 0.80 KDM1A (0.39) PGRARCYP11B1CYP11B2NR1H2
SCHEMBL4012188 0.76 NR1H2 (0.63) NR1H2NR1H3
SCHEMBL24453555 0.73 CLK4 (0.50) PDGFRBPDGFRACA12CA9CYP11B1

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-2023116835-A1 MULTI-PROTEIN DEGRADATION AGENT HAVING IMIDE SKELETON 苏州开拓药业股份有限公司 2023-06-29 — — WO disclosed
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