SCHEMBL9872014

SCHEMBL9872014

O=C(Oc1ccc(C(Cl)(Cl)Cl)cc1)C(F)(F)F

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.43
ELANE P08246 12/20 0.41
CYP11B1 P15538 2/20 0.37
CYP11B2 P19099 2/20 0.37
PRSS1 P07477 1/20 0.36
ACR P10323 1/20 0.36
MAPT P10636 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL6851503 0.81 MAPT (0.54) ELANEPRSS1ACRMAPTTDP1
SCHEMBL10392862 0.81 ELANE (0.50) KIF11ELANEMAPTTDP1L3MBTL1
SCHEMBL10738024 0.80 ELANE (0.56) ELANECYP11B1CYP11B2MAPT
SCHEMBL9445972 0.79 KMT2A (0.45) KIF11ELANEMAPTTDP1L3MBTL1
SCHEMBL26343991 0.79 ELANE (0.53) ELANEMAPTTDP1
SCHEMBL2651602 0.78 ELANE (0.45) KIF11ELANE
SCHEMBL10489119 0.78 KIF11 (0.39) KIF11ELANECYP11B1CYP11B2MAPT
SCHEMBL9872338 0.76 LMNA (0.57) ELANE
SCHEMBL326469 0.76 ELANE (0.44) KIF11ELANE
SCHEMBL8538472 0.76 ELANE (0.44) KIF11ELANEMAPTL3MBTL1

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
US-5047584-A Process for the preparation of pentahaloethoxy benzoyl halide compounds OCCIDENTAL CHEMICAL CORP. (US) 1991-09-10 US disclosed