SCHEMBL9242133

SCHEMBL9242133

COc1cc(-c2oc(-c3cc(OC)c(OCc4ccccc4)c(OC)c3)c(CC(C)C)c2CC(C)C)cc(OC)c1OCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 1/20 0.45
▸ MEN1 O00255 3/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ ALDH1A1 P00352 4/20 0.42
▸ KDM4E B2RXH2 3/20 0.42
▸ TSHR P16473 2/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ USP2 O75604 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ GAA P10253 2/20 0.42
▸ MGAM O43451 1/20 0.42
▸ SI P14410 1/20 0.42
▸ MGAM2 Q2M2H8 1/20 0.42
▸ BCHE P06276 4/20 0.40
▸ PDE4A P27815 1/20 0.40
▸ PDE4B Q07343 1/20 0.40
▸ PDE4C Q08493 1/20 0.40
▸ PDE4D Q08499 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 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
SCHEMBL8843771 0.86 PDE4A (0.52) KMT2AALDH1A1KDM4ETSHRHSD17B10
SCHEMBL8843736 0.86 TSHR (0.55) MEN1KMT2AALDH1A1KDM4ETSHR
SCHEMBL8843773 0.84 PPARG (0.48) PPARGMEN1KMT2ATDP1ALDH1A1
SCHEMBL10429223 0.75 KDM4E (0.48) PPARGMEN1KMT2AALDH1A1KDM4E
SCHEMBL5325075 0.74 KMT2A (0.47) MEN1KMT2ATDP1ALDH1A1KDM4E
SCHEMBL19738039 0.74 KMT2A (0.50) MEN1KMT2ATDP1ALDH1A1KDM4E
SCHEMBL5308504 0.74 TAAR1 (0.51) MEN1KMT2ATDP1
SCHEMBL5308499 0.74 TAAR1 (0.51) MEN1KMT2ATDP1
SCHEMBL27998563 0.73 MAOB (0.59) PPARGMEN1KMT2AALDH1A1GAA
SCHEMBL12431888 0.73 HTR1A (0.50) MEN1KMT2ATDP1ALDH1A1KDM4E

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-0678296-A1 VASCULARIZATION INHIBITOR AND NOVEL COMPOUND TSUMURA & CO. (JP) 1995-10-25 — — EP disclosed
Send feedback