SCHEMBL9064006

SCHEMBL9064006

Cc1ccc(C2=C(C(=O)O)CC(c3ccc(C)cc3)=C(C(=O)O)C2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
KDM4E B2RXH2 4/20 0.43
HPGD P15428 2/20 0.43
USP2 O75604 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MCL1 Q07820 1/20 0.43
SRD5A2 P31213 1/20 0.42
GAA P10253 2/20 0.40
RAB9A P51151 1/20 0.40
ALPL P05186 1/20 0.40
AKR1C2 P52895 1/20 0.39
AKR1C1 Q04828 1/20 0.39
KMT2A Q03164 1/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
CES2 O00748 2/20 0.38
CES1 P23141 2/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL8905393 0.80 CFTR (0.50) ALDH1A1SMN1; SMN2KDM4EHPGDMCL1
SCHEMBL9856614 0.79 SLC6A3 (0.53) ALDH1A1SMN1; SMN2KDM4EHPGDGAA
SCHEMBL6503402 0.79 SLC6A3 (0.51) ALDH1A1SMN1; SMN2KDM4EFFAR4LMNA
SCHEMBL6491174 0.79 SLC6A3 (0.55) ALDH1A1SMN1; SMN2KDM4EHPGDUSP2
SCHEMBL6502875 0.79 SLC6A3 (0.55) ALDH1A1SMN1; SMN2KDM4EHPGDUSP2
SCHEMBL6493029 0.79 SLC6A3 (0.55) ALDH1A1SMN1; SMN2KDM4EHPGDUSP2
SCHEMBL6502878 0.79 SLC6A3 (0.55) ALDH1A1SMN1; SMN2KDM4EHPGDUSP2
Hydrochloric Acid SCHEMBL6501875 0.77 SLC6A3 (0.54) ALDH1A1SMN1; SMN2KDM4EHPGDUSP2
Acetic Acid SCHEMBL15333210 0.69 SMN1; SMN2 (0.55) ALDH1A1SMN1; SMN2KDM4EHPGDUSP2
SCHEMBL13888048 0.69 ALDH1A1 (0.85) ALDH1A1SMN1; SMN2KDM4EHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0536083-B1 Process for the synthesis of dialkyl succinylsuccinate esters and their conversion to dialkyl 2,5-diarylamino-3,6-dihydroterephthalate esters CIBA GEIGY AG (CH) 1996-03-06 EP disclosed
EP-0536083-A1 Process for the synthesis of dialkyl succinylsuccinate esters and their conversion to dialkyl 2,5-diarylamino-3,6-dihydroterephthalate esters CIBA-GEIGY AG (CH) 1993-04-07 EP disclosed