SCHEMBL8628744

SCHEMBL8628744

Cc1ccc(Oc2ccc(C(=O)O)c(C(=O)O)c2)c(Oc2ccc(C(=O)O)c(C(=O)O)c2)c1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.51
POLB P06746 2/20 0.51
KDM4E B2RXH2 1/20 0.51
PYGL P06737 7/20 0.51
PYGM P11217 6/20 0.48
TDP1 Q9NUW8 2/20 0.45
CSNK2A1 P68400 1/20 0.43
MAPK1 P28482 1/20 0.43
GFER P55789 1/20 0.43
HPSE Q9Y251 1/20 0.43
LMNA P02545 1/20 0.42
AKR1C3 P42330 1/20 0.42
AKR1C2 P52895 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
SCHEMBL11230257 0.83 POLB (0.63) ALDH1A1POLBKDM4ETDP1CSNK2A1
SCHEMBL9847786 0.81 ALDH1A1 (0.49) ALDH1A1POLBKDM4EPYGLPYGM
SCHEMBL29664286 0.81 POLB (0.65) ALDH1A1POLBKDM4EPYGLPYGM
SCHEMBL7969637 0.81 POLB (0.65) ALDH1A1POLBKDM4EPYGLPYGM
SCHEMBL8628820 0.80 TDP1 (0.49) ALDH1A1POLBKDM4EPYGLPYGM
SCHEMBL8632254 0.80 TTR (0.55) ALDH1A1GFER
SCHEMBL28650646 0.80 POLB (0.63) ALDH1A1POLBKDM4EPYGLPYGM
SCHEMBL31152670 0.79 POLB (0.56) ALDH1A1POLBKDM4EPYGLPYGM
SCHEMBL21177832 0.79 GFER (0.64) ALDH1A1POLBKDM4ETDP1MAPK1
SCHEMBL49365 0.78 POLB (0.70) ALDH1A1POLBKDM4EPYGLPYGM

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-0757702-B1 POLY (IMIDE-ETHERS) DU PONT (US) 1998-07-01 EP disclosed
US-5675020-A CHEMICAL INTERMEDIATES FOR PREPARING AROMATIC POLYIMIDES THE UNIVERSITY OF LIVERPOOL (GB) 1997-10-07 US disclosed
US-5434240-A Films. fibers, encapsulation, thermoplastics THE UNIVERSITY OF LIVERPOOL (GB) 1995-07-18 US disclosed