SCHEMBL9637906

SCHEMBL9637906

CCOc1c(F)cc([C@](Cl)(COCc2ccc(F)c(Oc3ccccc3)c2)C(F)(F)F)cc1F

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.33
ATM Q13315 2/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
TTR P02766 1/20 0.33
TACR1 P25103 1/20 0.31
MRGPRX4 Q96LA9 1/20 0.31
LTA4H P09960 1/20 0.31
ALOX5 P09917 1/20 0.31
PPARG P37231 1/20 0.31
PSEN1 P49768 1/20 0.31
RORC P51449 1/20 0.31
POLB P06746 1/20 0.30
HCRTR1 O43613 3/20 0.30
HCRTR2 O43614 3/20 0.30
FFAR1 O14842 2/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL9637902 1.00 L3MBTL1 (0.33) L3MBTL1ATMLMNAMAPTTTR
SCHEMBL9560321 0.91 MAPT (0.40) L3MBTL1ATMLMNAMAPTTTR
SCHEMBL9561537 0.88 CETP (0.39) L3MBTL1ATMLMNALTA4HFFAR1
SCHEMBL9561530 0.88 CETP (0.39) L3MBTL1ATMLMNALTA4HFFAR1
SCHEMBL9561496 0.86 ALOX5 (0.33) L3MBTL1ATMLMNAMAPTTTR
SCHEMBL9561491 0.86 ALOX5 (0.33) L3MBTL1ATMLMNAMAPTTTR
SCHEMBL9560383 0.86 TTR (0.34) MAPTTTRTACR1LTA4HALOX5
SCHEMBL9560696 0.86 TACR1 (0.36) TTRTACR1MRGPRX4POLBKMT2A
SCHEMBL9560787 0.86 L3MBTL1 (0.34) L3MBTL1ATMLMNATTRTACR1
SCHEMBL9561293 0.86 LMNA (0.35) L3MBTL1LMNATTRTACR1MRGPRX4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0276558-B1 INSECTICIDAL ETHERS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-07-08 EP disclosed
EP-0276558-A2 Insecticidal ethers IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1988-08-03 EP disclosed