SCHEMBL8551634

SCHEMBL8551634

COc1c(C)c2c(c(N)c1C/C=C1\CCCCC1CC(=O)O)C(=O)OC2

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
IMPDH1 P20839 15/20 0.69
IMPDH2 P12268 13/20 0.69
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
HPGD P15428 1/20 0.46
UGT2B7 P16662 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HSD17B10 Q99714 1/20 0.46

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
SCHEMBL8546514 1.00 IMPDH1 (0.69) IMPDH1IMPDH2KDM4EALDH1A1LMNA
SCHEMBL1152618 0.97 IMPDH1 (0.73) IMPDH1IMPDH2KDM4EALDH1A1LMNA
SCHEMBL1153706 0.91 IMPDH1 (0.58) IMPDH1IMPDH2KDM4EALDH1A1LMNA
SCHEMBL8544680 0.91 IMPDH1 (0.58) IMPDH1IMPDH2KDM4EALDH1A1LMNA
SCHEMBL8545110 0.89 IMPDH1 (0.55) IMPDH1IMPDH2KDM4EALDH1A1LMNA
SCHEMBL8544613 0.89 IMPDH1 (0.55) IMPDH1IMPDH2KDM4EALDH1A1LMNA
SCHEMBL7877371 0.88 IMPDH1 (0.60) IMPDH1IMPDH2KDM4EALDH1A1LMNA
SCHEMBL9084374 0.88 IMPDH1 (0.60) IMPDH1IMPDH2KDM4EALDH1A1LMNA
SCHEMBL7877375 0.88 IMPDH1 (0.60) IMPDH1IMPDH2KDM4EALDH1A1LMNA
SCHEMBL1153362 0.88 IMPDH1 (0.60) IMPDH1IMPDH2KDM4EALDH1A1LMNA

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-0745072-B1 4-AMINO DERIVATIVES OF 5-SUBSTITUTED MYCOPHENOLIC ACID SYNTEX INC (US) 1998-05-06 EP disclosed