SCHEMBL30744976

SCHEMBL30744976

COC(=O)c1cccc(OC(F)F)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.56
KDM4E B2RXH2 1/20 0.55
KMT2A Q03164 5/20 0.55
MEN1 O00255 4/20 0.55
NPSR1 Q6W5P4 3/20 0.55
MAPT P10636 3/20 0.55
RAB9A P51151 3/20 0.55
SENP8 Q96LD8 1/20 0.55
SENP7 Q9BQF6 1/20 0.55
SENP6 Q9GZR1 1/20 0.55
TDP1 Q9NUW8 2/20 0.54
SMN1; SMN2 Q16637 5/20 0.54
TP53 P04637 2/20 0.54
NPC1 O15118 2/20 0.53
ATM Q13315 1/20 0.52
GAA P10253 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
MRGPRX4 Q96LA9 1/20 0.50
TSHR P16473 1/20 0.50
LOXL2 Q9Y4K0 1/20 0.50

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
SCHEMBL1854891 1.00 LMNA (0.56) LMNAKDM4EKMT2AMEN1NPSR1
SCHEMBL7466621 0.91 KMT2A (0.51) LMNAKDM4EKMT2AMEN1NPSR1
SCHEMBL4112022 0.85 RAB9A (0.61) LMNAKMT2AMEN1NPSR1MAPT
SCHEMBL27672005 0.84 SMN1; SMN2 (0.55) LMNAKDM4EKMT2AMEN1MAPT
SCHEMBL6174966 0.84 SMN1; SMN2 (0.59) LMNAKDM4EKMT2AMEN1RAB9A
SCHEMBL4035515 0.84 MAPT (0.56) LMNAKDM4EKMT2AMEN1MAPT
SCHEMBL3855637 0.84 CA1 (0.48) LMNAKDM4EMAPTTDP1GAA
SCHEMBL24803508 0.83 LMNA (0.53) LMNAKDM4EKMT2AMEN1NPSR1
SCHEMBL6283849 0.83 SMN1; SMN2 (0.54) LMNAKDM4EKMT2AMEN1MAPT
SCHEMBL24803573 0.83 KMT2A (0.51) LMNAKDM4EKMT2AMEN1NPSR1

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
CN-111295382-B Bridged bicyclic compounds as farnesyl ester X receptor modulators 百时美施贵宝公司 2024-02-02 CN disclosed