Sugi Predict

Sugi Predict / Compounds / SCHEMBL7070362

SCHEMBL7070362

SCHEMBL7070362

Oc1ccc2c(c1)C(=Cc1ccccc1)C1(C=c3ccc(O)cc3=C1)C2

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 8/20 0.45
▸ MAOA P21397 6/20 0.45
▸ MIF P14174 2/20 0.39
▸ CES2 O00748 1/20 0.35
▸ CYP26A1 O43174 1/20 0.33
▸ TNF P01375 3/20 0.33
▸ ESR1 P03372 2/20 0.33
▸ ESR2 Q92731 2/20 0.33
▸ CYP19A1 P11511 1/20 0.32

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
SCHEMBL6800031 0.77 MAOB (0.48) MAOBMAOAMIFCES2CYP26A1
SCHEMBL6802016 0.77 MAOB (0.48) MAOBMAOAMIFCES2CYP26A1
SCHEMBL6797976 0.68 MAOB (0.46) MAOBMAOAMIFCES2CYP26A1
SCHEMBL6796287 0.68 MAOB (0.46) MAOBMAOAMIFCES2CYP26A1
SCHEMBL7075372 0.66 ESR2 (0.40) MAOBMAOAMIFCYP26A1ESR1
SCHEMBL6806457 0.65 MAOB (0.47) MAOBMAOACES2CYP19A1
SCHEMBL6799865 0.65 MAOB (0.47) MAOBMAOACES2CYP19A1
SCHEMBL30214426 0.62 MAOB (1.00) MAOBMAOAMIFCES2TNF
SCHEMBL28949949 0.62 MAOB (1.00) MAOBMAOAMIFCES2TNF
SCHEMBL19682904 0.62 MAOB (1.00) MAOBMAOAMIFCES2TNF

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-1339662-A1 NOVEL ESTROGEN RECEPTOR LIGANDS AND METHODS III KARO BIO AB (SE) 2003-09-03 — — EP disclosed
WO-2002046134-A1 NOVEL ESTROGEN RECEPTOR LIGANDS AND METHODS III KARO BIO AB (SE) 2002-06-13 — — WO disclosed