SCHEMBL7468599

SCHEMBL7468599

CSC1(SC)CCOc2cccc(C(=O)O)c21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.36
GAA P10253 1/20 0.36
ALOX5 P09917 1/20 0.36
MCL1 Q07820 1/20 0.35
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34
HDAC2 Q92769 1/20 0.34
HDAC10 Q969S8 1/20 0.34
HDAC11 Q96DB2 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC9 Q9UKV0 1/20 0.34
HDAC5 Q9UQL6 1/20 0.34
MYC P01106 1/20 0.34
ALDH1A1 P00352 4/20 0.33
KDM4E B2RXH2 3/20 0.33

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
SCHEMBL6349021 0.85 ALOX5 (0.42) MEN1KMT2ASMN1; SMN2ALOX5ALDH1A1
SCHEMBL7839853 0.82 SMN1; SMN2 (0.33) MEN1KMT2ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL6344023 0.78 SMN1; SMN2 (0.33) SMN1; SMN2GAASLC9A1SLC9A5SLC9A2
SCHEMBL6350747 0.76 KDM4E (0.35) MEN1KMT2ASMN1; SMN2GAAALDH1A1
SCHEMBL6350809 0.73 CTNNB1 (0.37) GAAALDH1A1CTNNB1WNT3ATP53
SCHEMBL6340520 0.72 RARB (0.35)
SCHEMBL8458842 0.70 MEN1 (0.38) MEN1KMT2ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL6338640 0.70 DRD2 (0.34)
SCHEMBL8101913 0.70 RARB (0.53) ALDH1A1
SCHEMBL3177133 0.69 ITGB2 (0.41) KMT2ASMN1; SMN2GAA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0977749-B1 BI-AROMATIC COMPOUNDS AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME GALDERMA RES & DEV (FR) 2002-03-13 EP disclosed
EP-0977749-A1 BI-AROMATIC COMPOUNDS AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME Galderma Research & Development (FR) 2000-02-09 EP disclosed
WO-1998056783-A1 BI-AROMATIC COMPOUNDS AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME GALDERMA RESEARCH & DEVELOPMENT (FR) 1998-12-17 WO disclosed