SCHEMBL8090728

SCHEMBL8090728

O=C(c1cccc(O)c1-c1ccc(O)cc1)c1cccc(O)c1-c1ccc(O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIG1 P18858 1/20 0.50
LMNA P02545 3/20 0.46
GSTA1 P08263 1/20 0.44
BACE1 P56817 1/20 0.44
MEN1 O00255 4/20 0.42
KMT2A Q03164 4/20 0.42
MAPT P10636 3/20 0.42
RAB9A P51151 1/20 0.42
MMP2 P08253 1/20 0.42
MMP3 P08254 1/20 0.42
APP P05067 1/20 0.41
PRKCB P05771 1/20 0.41
ESR1 P03372 3/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 3/20 0.40
KDM4E B2RXH2 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CYP3A4 P08684 2/20 0.40
ALOX15 P16050 2/20 0.40
CYP19A1 P11511 1/20 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
SCHEMBL8936342 0.80 ESR1 (0.53) LMNABACE1MEN1KMT2AMAPT
SCHEMBL21694726 0.79 ALDH1A1 (0.58) LMNAGSTA1MAPTMMP2PRKCB
SCHEMBL92724 0.77 AKR1C3 (0.52) LIG1LMNAGSTA1MEN1KMT2A
SCHEMBL18529872 0.76 GSTA1 (0.50) LIG1LMNAGSTA1MAPTRAB9A
SCHEMBL27271193 0.75 ALDH1A1 (0.47) BACE1MEN1KMT2AMAPTALDH1A1
SCHEMBL623796 0.73 ALDH1A1 (0.61) LMNAGSTA1MAPTALDH1A1HPGD
SCHEMBL28312144 0.72 BACE1 (0.51) LMNABACE1MEN1KMT2AMAPT
SCHEMBL9065832 0.72 KMT2A (0.56) LIG1LMNAMEN1KMT2AMAPT
SCHEMBL13589361 0.72 GSTA1 (0.83) LIG1LMNAGSTA1MEN1KMT2A
SCHEMBL5013557 0.71 ABL1 (0.52) LIG1LMNAGSTA1BACE1MEN1

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-0637613-B1 RESIN COMPOSITION MITSUBISHI GAS CHEMICAL CO (JP) 2000-10-25 EP disclosed
US-5543474-A BLEND OF A AROMATIC POLYAMIDEIMIDE COPOLYMER AND A POLYESTER MITSUBISHI GAS COMPANY, INC. (JP) 1996-08-06 US disclosed
EP-0637613-A1 RESIN COMPOSITION MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1995-02-08 EP disclosed