SCHEMBL31716882

SCHEMBL31716882

COc1cc2c(=O)[nH]c(Cc3ccc(-c4cc(F)cc(F)c4)nc3)nc2cc1SC

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.46
▸ LMNA P02545 4/20 0.45
▸ KDM4E B2RXH2 4/20 0.39
▸ GAA P10253 2/20 0.39
▸ ROCK2 O75116 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ CASP1 P29466 1/20 0.38
▸ HBB P68871 1/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ USP2 O75604 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ MET P08581 2/20 0.37
▸ PDE10A Q9Y233 2/20 0.36
▸ THRB P10828 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
SCHEMBL31716946 0.89 LMNA (0.44) MAPK1LMNAKDM4EGAAROCK2
SCHEMBL31717042 0.88 LMNA (0.43) MAPK1LMNAKDM4EGAAROCK2
SCHEMBL31716050 0.86 LMNA (0.43) MAPK1LMNAKDM4EGAAROCK2
SCHEMBL31716955 0.86 LMNA (0.43) MAPK1LMNAKDM4EGAAROCK2
SCHEMBL31715980 0.86 LMNA (0.42) MAPK1LMNAKDM4EGAAROCK2
SCHEMBL31715994 0.84 KDM4E (0.46) MAPK1LMNAKDM4EGAAROCK2
SCHEMBL31716099 0.84 LMNA (0.41) MAPK1LMNAKDM4EGAAROCK2
Hydrochloric Acid SCHEMBL31716568 0.84 LMNA (0.45) MAPK1LMNAKDM4EGAAROCK2
SCHEMBL31715978 0.83 LMNA (0.48) MAPK1LMNAKDM4EGAAROCK2
SCHEMBL31715976 0.83 KDM4E (0.49) LMNAKDM4EROCK2PDE10A

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-2025227032-A1 METHODS FOR DEGRADATION OF CYCLIN K AND INHIBITION OF CYCLIN DEPENDENT KINASES REMIX THERAPEUTICS INC. (US) 2025-10-30 — — WO disclosed
Send feedback