SCHEMBL9230569

SCHEMBL9230569

Cc1ccc(F)cc1C(=O)c1cccc(OC(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.46
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
TAS1R2 Q8TE23 1/20 0.43
KAT6A Q92794 3/20 0.42
LTC4S Q16873 1/20 0.42
F10 P00742 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
KCNQ3 O43525 1/20 0.41
KCNQ2 O43526 1/20 0.41
GPR139 Q6DWJ6 1/20 0.40
BRAF P15056 1/20 0.39
P2RX1 P51575 1/20 0.39
HPD P32754 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
WDR5 P61964 1/20 0.39

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
SCHEMBL9231659 0.93 LTC4S (0.46) HSD11B1TAS1R3TAS1R1TAS1R2KAT6A
SCHEMBL27486585 0.85 KAT6A (0.47) HSD11B1TAS1R3TAS1R1TAS1R2KAT6A
SCHEMBL1773416 0.85 RAB9A (0.56) HSD11B1NPC1RAB9ASMN1; SMN2
SCHEMBL9229708 0.84 LTC4S (0.48) HSD11B1TAS1R3TAS1R1TAS1R2KAT6A
SCHEMBL9230984 0.84 LTC4S (0.53) HSD11B1TAS1R3TAS1R1TAS1R2KAT6A
SCHEMBL14415761 0.81 CES2 (0.53) NPC1RAB9ABRAFSMN1; SMN2
SCHEMBL690501 0.80 KAT6A (0.54) HSD11B1TAS1R3TAS1R1TAS1R2KAT6A
SCHEMBL1773728 0.80 CES2 (0.53) RAB9ABRAF
SCHEMBL27437820 0.78 LTC4S (0.43) HSD11B1KAT6ALTC4SF10GPR139
SCHEMBL14297682 0.77 ELANE (0.49) TAS1R3TAS1R1TAS1R2KAT6AHDAC8

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
EP-0634404-A1 Phtalazin derivatives and their use as pesticides RHONE POULENC AGRICULTURE LTD. (GB) 1995-01-18 EP disclosed