SCHEMBL31435330

SCHEMBL31435330

O=C(O)c1ccc(C2CC2)c(C(F)(F)F)n1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
ALOX15 P16050 1/20 0.41
TSHR P16473 1/20 0.41
ACMSD Q8TDX5 1/20 0.41
RBP4 P02753 4/20 0.39
CNR2 P34972 9/20 0.38
KMT2A Q03164 2/20 0.36
GLA P06280 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HIF1A Q16665 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CNR1 P21554 2/20 0.36
MRGPRX4 Q96LA9 1/20 0.36
HCAR2 Q8TDS4 1/20 0.36
MGAM O43451 1/20 0.35

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
SCHEMBL31435346 0.82 RBP4 (0.44) RBP4CNR2CNR1
SCHEMBL14152296 0.77 CNR2 (0.62) CNR2CNR1
SCHEMBL31435334 0.77 RBP4 (0.43) RBP4CNR2MRGPRX4
SCHEMBL31435282 0.76 RBP4 (0.42) TDP1RBP4CNR2KMT2A
SCHEMBL14151940 0.75 KDM4E (0.45) KDM4ETDP1ALOX15TSHRACMSD
SCHEMBL27906120 0.74 XPO1 (0.42) KDM4ETDP1ALOX15TSHRACMSD
SCHEMBL22234858 0.74 KDM4E (0.43) KDM4ETDP1ALOX15TSHRACMSD
SCHEMBL27087492 0.74 KDM4E (0.44) KDM4ETDP1ALOX15TSHRACMSD
SCHEMBL24775003 0.73 KDM4E (0.42) KDM4ETDP1ALOX15TSHRACMSD
SCHEMBL31435345 0.73 BACE1 (0.36) KDM4EKMT2A

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-2025090792-A1 AMIDE PRODRUGS AND USES THEREOF AUTOBAHN THERAPEUTICS, INC. (US) 2025-05-01 WO disclosed