SCHEMBL8349185

SCHEMBL8349185

COc1ccc(CN)cc1OC.NCc1ccc(Cl)c(Cl)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.56
▸ ATM Q13315 1/20 0.56
▸ CSNK2A1 P68400 5/20 0.54
▸ CA2 P00918 1/20 0.53
▸ LMNA P02545 3/20 0.52
▸ CLK4 Q9HAZ1 2/20 0.52
▸ MEN1 O00255 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ CDK8 P49336 1/20 0.52
▸ GAA P10253 1/20 0.51
▸ CRHBP P24387 1/20 0.51
▸ CRHR2 Q13324 1/20 0.51
▸ CYP19A1 P11511 1/20 0.49
▸ PNMT P11086 1/20 0.47
▸ TAAR1 Q96RJ0 1/20 0.47
▸ AOC3 Q16853 1/20 0.46
▸ DYRK1A Q13627 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46

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
SCHEMBL44393 0.87 ATM (0.70) KDM4EATMCA2MAPK1KMT2A
SCHEMBL29535675 0.87 ATM (0.70) KDM4EATMCA2MAPK1KMT2A
SCHEMBL19409880 0.87 ATM (0.70) KDM4EATMCA2MAPK1KMT2A
SCHEMBL506373 0.85 CSNK2A1 (0.66) KDM4EATMCSNK2A1CA2MEN1
SCHEMBL29673212 0.85 CSNK2A1 (0.51) KDM4EATMCSNK2A1CA2LMNA
SCHEMBL559310 0.85 CSNK2A1 (0.51) KDM4EATMCSNK2A1CA2LMNA
Hydrochloric Acid SCHEMBL9726669 0.85 ATM (0.68) KDM4EATMCSNK2A1CA2LMNA
Hydrochloric Acid SCHEMBL8299478 0.84 CSNK2A1 (0.53) KDM4EATMCSNK2A1CA2LMNA
Hydrochloric Acid SCHEMBL856874 0.84 CSNK2A1 (0.67) KDM4EATMCSNK2A1LMNAMEN1
SCHEMBL8349187 0.81 LMNA (0.62) KDM4ECA2LMNACLK4MEN1

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
WO-1999031506-A9 PARALLEL SOLUTION PHASE SYNTHESIS OF LACTAMS LILLY CO ELI (US) 1999-09-16 — — WO disclosed
WO-1999031507-A1 PEPTIDOMIMETIC TEMPLATE-BASED COMBINATORIAL LIBRARIES ELI LILLY AND COMPANY (US) 1999-06-24 — — WO disclosed
WO-1999031506-A1 PARALLEL SOLUTION PHASE SYNTHESIS OF LACTAMS ELI LILLY AND COMPANY (US) 1999-06-24 — — WO disclosed
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