SCHEMBL31716038

SCHEMBL31716038

O=c1[nH]c(Cc2ccc(-c3cc(F)cc(F)c3)nc2)nc2cc(Br)c(OC(F)F)cc12

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.37
▸ ATM Q13315 1/20 0.37
▸ HTT P42858 1/20 0.36
▸ LMNA P02545 3/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ ROCK2 O75116 5/20 0.35
▸ ROCK1 Q13464 2/20 0.35
▸ MAPK1 P28482 1/20 0.34
▸ KMT2A Q03164 1/20 0.33
▸ RNASEH1 O60930 1/20 0.33
▸ PDE4B Q07343 1/20 0.33
▸ PDE10A Q9Y233 1/20 0.33
▸ GAA P10253 1/20 0.31
▸ MBOAT4 Q96T53 1/20 0.31

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) KDM4ELMNAROCK2MAPK1RNASEH1
SCHEMBL31716050 0.86 LMNA (0.43) KDM4ELMNAROCK2MAPK1RNASEH1
SCHEMBL31716260 0.84 PDE5A (0.36) KDM4ELMNANPC1RAB9AROCK2
SCHEMBL31716882 0.82 MAPK1 (0.46) KDM4ELMNAROCK2MAPK1PDE10A
SCHEMBL31717042 0.81 LMNA (0.43) KDM4ELMNAROCK2MAPK1RNASEH1
SCHEMBL31716933 0.80 LMNA (0.43) KDM4ELMNAROCK2MAPK1RNASEH1
SCHEMBL31716955 0.79 LMNA (0.43) KDM4ELMNAROCK2MAPK1GAA
SCHEMBL31715980 0.79 LMNA (0.42) KDM4ELMNAROCK2MAPK1PDE10A
SCHEMBL31715976 0.77 KDM4E (0.49) KDM4ELMNAROCK2ROCK1KMT2A
SCHEMBL31716019 0.77 PDE5A (0.38) KDM4ELMNAROCK2ROCK1KMT2A

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
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