SCHEMBL8635291

SCHEMBL8635291

CCOC(=O)C(Cl)=CC1C(C(N)=O)=C(C(=O)Nc2ccccc2)CCC1Cl

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.40
▸ TSHR P16473 2/20 0.39
▸ PTPN11 Q06124 1/20 0.37
▸ RAB9A P51151 4/20 0.35
▸ SMN1; SMN2 Q16637 4/20 0.35
▸ MAPT P10636 3/20 0.35
▸ NPC1 O15118 3/20 0.35
▸ GAA P10253 2/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ ALDH1A1 P00352 6/20 0.35
▸ NFKB1 P19838 1/20 0.35
▸ NFKB2 Q00653 1/20 0.35
▸ RELA Q04206 1/20 0.35
▸ CA12 O43570 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ AURKA O14965 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
SCHEMBL8638850 0.68 GAA (0.36) KDM4ERAB9ASMN1; SMN2MAPTNPC1
SCHEMBL13381411 0.64 ALDH1A1 (0.56) KDM4ERAB9ASMN1; SMN2MAPTNPC1
SCHEMBL7762961 0.63 NPSR1 (0.39) KDM4ETSHRRAB9ASMN1; SMN2MAPT
SCHEMBL23331615 0.62 MAPT (0.54) KDM4ERAB9ASMN1; SMN2MAPTNPC1
SCHEMBL2488639 0.61 MAPT (0.70) KDM4ESMN1; SMN2MAPTGAATDP1
SCHEMBL20195801 0.61 KDM4E (0.51) KDM4ERAB9ASMN1; SMN2MAPTNPC1
SCHEMBL11675189 0.61 MAPK1 (0.44) RAB9ASMN1; SMN2MAPTNPC1TDP1
SCHEMBL9750990 0.61 MAPT (0.55) KDM4ERAB9ASMN1; SMN2MAPTNPC1
SCHEMBL3631341 0.61 MAPT (0.55) KDM4ERAB9ASMN1; SMN2MAPTNPC1
SCHEMBL3196733 0.61 ALDH1A1 (0.52) KDM4ERAB9ASMN1; SMN2MAPTNPC1

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
US-5817603-A HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1998-10-06 — — US disclosed
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