SCHEMBL26465513

SCHEMBL26465513

Cc1ccc(NC(=O)c2cccc(Cl)c2)cc1C

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KCNK3 O14649 2/20 0.69
▸ KCNK9 Q9NPC2 2/20 0.69
▸ RAB9A P51151 6/20 0.66
▸ NPC1 O15118 5/20 0.66
▸ KMT2A Q03164 1/20 0.66
▸ BRAF P15056 1/20 0.62
▸ FKBP5 Q13451 1/20 0.62
▸ MAOA P21397 1/20 0.62
▸ MAOB P27338 1/20 0.62
▸ RXFP1 Q9HBX9 1/20 0.60
▸ SMN1; SMN2 Q16637 2/20 0.60
▸ KCNQ3 O43525 2/20 0.59
▸ KCNQ2 O43526 2/20 0.59
▸ KCNE1 P15382 2/20 0.59
▸ KCNQ1 P51787 2/20 0.59
▸ TP53 P04637 1/20 0.59
▸ MAPT P10636 1/20 0.59
▸ HPGD P15428 1/20 0.59
▸ CSF1R P07333 1/20 0.59
▸ KCNQ5 Q9NR82 1/20 0.58

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
SCHEMBL14426560 0.90 KCNK3 (0.68) KCNK3KCNK9RAB9ANPC1BRAF
SCHEMBL1924651 0.88 KCNK3 (0.66) KCNK3KCNK9RAB9ANPC1BRAF
SCHEMBL12192807 0.87 KCNK3 (0.64) KCNK3KCNK9RAB9ANPC1BRAF
SCHEMBL29071358 0.86 KCNK3 (0.63) KCNK3KCNK9RAB9ANPC1KMT2A
SCHEMBL29921751 0.86 KCNK3 (0.63) KCNK3KCNK9RAB9ANPC1KMT2A
SCHEMBL8363018 0.84 SMN1; SMN2 (0.76) KCNK3KCNK9RAB9ANPC1KMT2A
SCHEMBL15006333 0.84 KCNK3 (0.76) KCNK3KCNK9RAB9ANPC1KMT2A
SCHEMBL3675463 0.84 KCNK3 (0.84) KCNK3KCNK9RAB9ANPC1KMT2A
SCHEMBL19500728 0.84 KCNK3 (0.60) KCNK3KCNK9RAB9ANPC1KMT2A
SCHEMBL17620462 0.83 KCNK3 (0.91) KCNK3KCNK9RAB9ANPC1KMT2A

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
WO-2023073115-A1 PROTEIN AGGREGATION INHIBITING COMPOUNDS FOR PLANT DISEASE CONTROL MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2023-05-04 — — WO disclosed
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