SCHEMBL30777867

SCHEMBL30777867

Nc1ccc(Oc2cccnc2C(F)(F)F)cc1C(=O)Nc1cc(Cl)c(Cl)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATF1 P18846 2/20 0.47
▸ NFKB1 P19838 2/20 0.47
▸ BRAF P15056 7/20 0.45
▸ HDAC1 Q13547 6/20 0.45
▸ HDAC3 O15379 3/20 0.45
▸ HDAC4 P56524 3/20 0.45
▸ HDAC7 Q8WUI4 3/20 0.45
▸ HDAC2 Q92769 3/20 0.45
▸ HDAC10 Q969S8 3/20 0.45
▸ HDAC11 Q96DB2 3/20 0.45
▸ HDAC8 Q9BY41 3/20 0.45
▸ HDAC6 Q9UBN7 3/20 0.45
▸ HDAC9 Q9UKV0 3/20 0.45
▸ HDAC5 Q9UQL6 3/20 0.45
▸ RAF1 P04049 1/20 0.45
▸ ARAF P10398 1/20 0.45
▸ GRM4 Q14833 1/20 0.42
▸ MET P08581 1/20 0.42
▸ PNLIP P16233 1/20 0.42
▸ GCK P35557 2/20 0.42

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
SCHEMBL30777864 1.00 ATF1 (0.47) ATF1NFKB1BRAFHDAC1HDAC3
SCHEMBL17530353 1.00 ATF1 (0.47) ATF1NFKB1BRAFHDAC1HDAC3
SCHEMBL17542402 0.92 TDP1 (0.44) ATF1NFKB1BRAFHDAC1HDAC3
SCHEMBL21524954 0.90 BRAF (0.40) ATF1NFKB1BRAFHDAC1HDAC3
SCHEMBL30777869 0.87 KMT2A (0.47) ATF1NFKB1PNLIPP2RX1
SCHEMBL17530358 0.87 KMT2A (0.47) ATF1NFKB1PNLIPP2RX1
SCHEMBL17530347 0.84 ATF1 (0.43) ATF1NFKB1BRAFGRM4PNLIP
SCHEMBL12303377 0.79 CFTR (0.46) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL17530356 0.77 BRAF (0.59) BRAFHDAC1HDAC3HDAC4HDAC7
SCHEMBL17350355 0.76 BRAF (0.64) BRAFHDAC1HDAC3HDAC4HDAC7

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-3792251-B1 NOVEL SULFONYLAMINOBENZAMIDE COMPOUNDS AS ANTHELMINTICS ELANCO TIERGESUNDHEIT AG (CH) 2024-02-14 — — EP disclosed
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