SCHEMBL21187491

SCHEMBL21187491

Cc1cccc(-n2cnc3cc(COc4cc(F)c(-c5c(C)cccc5-n5cnc6cc(F)cc(F)c65)c(F)c4)ccc32)c1-c1ccc(F)cc1Cl

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 5/20 0.34
▸ FFAR4 Q5NUL3 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ ALOX5 P09917 1/20 0.31
▸ BTK Q06187 1/20 0.31
▸ HSD11B1 P28845 1/20 0.31
▸ CHRNA7 P36544 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
SCHEMBL21187455 0.83 HSD11B1 (0.42) BTKHSD11B1CHRNA7
SCHEMBL21187447 0.76 FGFR1 (0.44) KDM4EMAPTHPGDBTKHSD11B1
SCHEMBL21187448 0.76 FGFR1 (0.44) KDM4EALDH1A1MAPTHPGDHSD11B1
SCHEMBL21187502 0.75 ALDH1A1 (0.38) FFAR1ALDH1A1MAPTHPGDBTK
SCHEMBL21187500 0.74 HSD11B1 (0.43) HSD11B1
SCHEMBL21187498 0.69 HSD11B1 (0.39) HSD11B1
SCHEMBL21187456 0.69 MAPK14 (0.36) HSD11B1
SCHEMBL21182369 0.65 HSD11B1 (0.39) HSD11B1
SCHEMBL20697945 0.65 HSD11B1 (0.39) ALDH1A1HSD11B1
SCHEMBL20698166 0.65 HSD11B1 (0.41) HSD11B1

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-3740474-B1 AGRICULTURAL CHEMICALS GLOBACHEM NV (BE) 2022-01-05 — — EP disclosed
WO-2019141972-A1 AGRICULTURAL CHEMICALS GLOBACHEM NV (BE) 2019-07-25 — — WO disclosed
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