SCHEMBL11255943

SCHEMBL11255943

O=C(F)c1c(F)c(F)c(F)c(F)c1Cl

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
HTT P42858 2/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
BRD4 O60885 1/20 0.32
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
MAPK1 P28482 1/20 0.31
GAA P10253 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
SCHEMBL11263582 0.92 CES2 (0.56) CES2CES1HTTCA1CA2
SCHEMBL10709506 0.90 CES2 (0.46) CES2CES1
SCHEMBL10710744 0.89 CES2 (0.56) CES2CES1HTTCA1CA2
SCHEMBL317184 0.80 CES2 (0.43) CES2CES1HTTCA1CA2
SCHEMBL6448128 0.80 CES2 (0.43) CES2CES1HTTCA1CA2
SCHEMBL2916433 0.79 CES2 (0.52) CES2CES1HTTCA1CA2
SCHEMBL28071165 0.79 CES2 (0.52) CES2CES1HTTCA1CA2
SCHEMBL8680478 0.77 CES2 (0.50) CES2CES1HTTCA1CA2
SCHEMBL28018057 0.77 CES2 (0.50) CES2CES1HTTCA1CA2
SCHEMBL1900629 0.76 CES2 (0.39) CES2CES1HTTCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0023647-B1 Process for the preparation of halogenated benzoyl fluorides BAYER AG (DE) 1982-06-30 EP disclosed
US-4330366-A Process for the preparation of halogenated benzoyl fluorides BAYER AKTIENGESELLSCHAFT (DE) 1982-05-18 US disclosed
EP-0023647-A1 Process for the preparation of halogenated benzoyl fluorides BAYER AG (DE) 1981-02-11 EP disclosed