SCHEMBL11277290

SCHEMBL11277290

O=C(O)c1cccc(C(=O)Oc2ccc(C(=O)O)c(C(=O)O)c2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.53
ALDH1A1 P00352 1/20 0.51
MAPT P10636 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
AKR1C3 P42330 2/20 0.48
AKR1C2 P52895 1/20 0.48
KDM4E B2RXH2 1/20 0.47
HPSE Q9Y251 1/20 0.46
ESR1 P03372 4/20 0.45
ESR2 Q92731 3/20 0.45
PYGM P11217 2/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
PYGL P06737 1/20 0.43
PARP10 Q53GL7 1/20 0.42
APEX1 P27695 1/20 0.42
CTDSP1 Q9GZU7 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL28132328 0.97 POLB (0.55) POLBALDH1A1MAPTTDP1KMT2A
SCHEMBL11776210 0.88 KMT2A (0.64) POLBALDH1A1MAPTTDP1KMT2A
SCHEMBL11204741 0.88 MAPT (0.49) POLBALDH1A1MAPTTDP1KMT2A
SCHEMBL11193621 0.88 ESR1 (0.57) ALDH1A1MAPTTDP1KMT2AMEN1
SCHEMBL2048011 0.86 ALDH1A1 (0.58) POLBALDH1A1MAPTTDP1KMT2A
SCHEMBL8848151 0.86 LMNA (0.56) ALDH1A1MAPTTDP1KMT2AMEN1
SCHEMBL10786832 0.85 ALDH1A1 (0.56) POLBALDH1A1MAPTTDP1KMT2A
SCHEMBL10497239 0.84 AKR1C3 (0.56) MAPTTDP1KMT2AMEN1AKR1C3
SCHEMBL11196204 0.84 AKR1C3 (0.61) ALDH1A1MAPTTDP1KMT2AMEN1
SCHEMBL29513412 0.83 ALDH1A1 (0.54) POLBALDH1A1MAPTTDP1KMT2A

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
US-20210197428-A1 PROCESS FOR MANUFACTURING COMPOSITE ARTICLES SPECIALTY OPERATIONS FRANCE (FR) 2021-07-01 US disclosed
US-9809678-B2 Polycarbonate polyol compositions and methods SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2017-11-07 US disclosed
EP-0052927-A2 Stretched film structure of the poly-1,3-phenylene terephthalate type MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1982-06-02 EP disclosed