SCHEMBL11440098

SCHEMBL11440098

N#CSc1ccccc1C(=O)NCl

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 4/20 0.42
▸ LMNA P02545 2/20 0.42
▸ KMT2A Q03164 5/20 0.39
▸ MAPT P10636 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ HTT P42858 1/20 0.39
▸ HPGD P15428 5/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ SLC6A2 P23975 1/20 0.37
▸ SLC6A4 P31645 1/20 0.37
▸ SLC6A3 Q01959 1/20 0.37
▸ TDP1 Q9NUW8 2/20 0.36
▸ GAA P10253 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ TSHR P16473 2/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34

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
SCHEMBL11084593 0.83 SLC6A2 (0.54) POLBLMNAKMT2AMAPTMEN1
SCHEMBL5960318 0.80 ALDH1A1 (0.44) POLBLMNAKMT2AMAPTMEN1
SCHEMBL11094447 0.80 MAPT (0.47) POLBLMNAKMT2AMAPTMEN1
SCHEMBL11093857 0.80 LMNA (0.65) POLBLMNAKMT2AMAPTMEN1
SCHEMBL11095220 0.80 HPGD (0.46) POLBLMNAKMT2AHTTHPGD
SCHEMBL11097216 0.79 KMT2A (0.58) LMNAKMT2AHTTHPGDALDH1A1
SCHEMBL11440099 0.79 KDR (0.55) POLBLMNAKMT2AMAPTMEN1
SCHEMBL440880 0.78 POLB (0.61) POLBMAPTHPGDALDH1A1TDP1
SCHEMBL11096087 0.78 HPGD (0.47) POLBLMNAKMT2AMAPTMEN1
SCHEMBL10869194 0.77 SIRT1 (0.55) POLBLMNAKMT2AMAPTMEN1

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-0018100-A2 Substituted aromatic biologically active compound, a process for its preparation and its use as biocide IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1980-10-29 — — EP disclosed
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