SCHEMBL25361063

SCHEMBL25361063

O=C(Nc1c[c]cc(Cl)c1)C1CC1

nearest known ligand 0.60

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.60
▸ MEN1 O00255 5/20 0.60
▸ LMNA P02545 5/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.50
▸ HTT P42858 3/20 0.50
▸ HPGD P15428 2/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ ALOX12 P18054 1/20 0.50
▸ GAA P10253 4/20 0.46
▸ USP2 O75604 1/20 0.46
▸ NAMPT P43490 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.45
▸ GRM4 Q14833 2/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ GFER P55789 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 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
SCHEMBL18154026 0.82 MEN1 (0.86) KMT2AMEN1LMNASMN1; SMN2HTT
SCHEMBL23109077 0.76 MGLL (0.64) KMT2AMEN1LMNASMN1; SMN2HTT
SCHEMBL10344698 0.75 KMT2A (0.59) KMT2AMEN1LMNASMN1; SMN2HTT
SCHEMBL1947748 0.75 HSD17B10 (0.63) KMT2AMEN1LMNASMN1; SMN2HTT
SCHEMBL25360083 0.74 LMNA (0.45) KMT2AMEN1LMNASMN1; SMN2HTT
SCHEMBL9342656 0.74 KMT2A (0.72) KMT2AMEN1LMNASMN1; SMN2HTT
SCHEMBL2246735 0.74 MEN1 (0.96) KMT2AMEN1LMNASMN1; SMN2HPGD
SCHEMBL1921374 0.72 GAA (0.56) KMT2AMEN1LMNASMN1; SMN2HTT
SCHEMBL7020413 0.72 PTGIR (0.48) SMN1; SMN2ALDH1A1NPC1RAB9A
SCHEMBL10344645 0.71 NAMPT (0.53) KMT2AMEN1LMNASMN1; SMN2HTT

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-3904350-B1 N-(CYCLOPROPYLMETHYL)-5-(METHYLSULFONYL)-N-{1-[1-(PYRIMIDIN-2-YL)-1H-1,2,4-TRIAZOL-5-YL]ETHYL}BENZAMIDE DERIVATIVES AND THE CORRESPONDING PYRIDINE-CARBOXAMIDE DERIVATIVES AS PESTICIDES BAYER AG (DE) 2023-08-23 — — EP claimed
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