SCHEMBL14159034

SCHEMBL14159034

CCOC(=O)/C(=N\c1cc(Cl)c(O)c(Cl)c1)c1nc2ccccc2s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 6/20 0.47
▸ KMT2A Q03164 6/20 0.47
▸ MAPT P10636 5/20 0.47
▸ KDM4E B2RXH2 3/20 0.47
▸ GAA P10253 2/20 0.47
▸ SMN1; SMN2 Q16637 5/20 0.47
▸ RAB9A P51151 4/20 0.45
▸ NPC1 O15118 3/20 0.45
▸ MAPK1 P28482 2/20 0.45
▸ TP53 P04637 1/20 0.45
▸ NFKB1 P19838 1/20 0.45
▸ NFKB2 Q00653 1/20 0.45
▸ RELA Q04206 1/20 0.45
▸ ALDH1A1 P00352 5/20 0.43
▸ CYP2C9 P11712 1/20 0.42
▸ CNR1 P21554 1/20 0.41
▸ CNR2 P34972 1/20 0.41
▸ LMNA P02545 2/20 0.41
▸ ALOX15 P16050 1/20 0.40
▸ TSHR P16473 1/20 0.40

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
SCHEMBL15277477 0.82 MAPT (0.57) MEN1KMT2AMAPTKDM4EGAA
SCHEMBL6124062 0.75 MAPT (0.52) MEN1KMT2AMAPTKDM4EGAA
SCHEMBL10009486 0.74 MAPT (0.63) MEN1KMT2AMAPTKDM4EGAA
SCHEMBL14159012 0.72 RECQL (0.48) MEN1KMT2AMAPTKDM4ESMN1; SMN2
SCHEMBL211598 0.71 ALDH1A1 (0.69) MEN1KMT2AMAPTKDM4EGAA
SCHEMBL11482323 0.70 MEN1 (0.57) MEN1KMT2AMAPTKDM4EGAA
SCHEMBL3401020 0.67 MAPK1 (0.64) MEN1KMT2AMAPTKDM4EGAA
SCHEMBL3401066 0.66 SMN1; SMN2 (0.56) MEN1KMT2AMAPTKDM4EGAA
SCHEMBL16595635 0.66 PTPN1 (0.52) SMN1; SMN2LMNAPTPN1NPSR1
SCHEMBL10967696 0.65 SMN1; SMN2 (0.53) MEN1KMT2AMAPTGAASMN1; SMN2

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-1398021-B1 Hair dye composition KAO CORP (JP) 2008-06-18 — — EP disclosed
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