SCHEMBL20656751

SCHEMBL20656751

O=C(O)C1CCC(C(=O)OC(=O)C2CCC(C(=O)O)C(C(=O)O)C2C(=O)O)C(C(=O)O)C1C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 5/20 0.40
POLB P06746 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
APEX1 P27695 1/20 0.37
KDM4E B2RXH2 1/20 0.37
GMNN O75496 1/20 0.37
LMNA P02545 1/20 0.37
PMP22 Q01453 1/20 0.37
TFPI2 P48307 1/20 0.37
TP53 P04637 1/20 0.37
TSHR P16473 1/20 0.37
NFKB1 P19838 1/20 0.37
THPO P40225 1/20 0.37
PPM1B O75688 2/20 0.36
PTPN1 P18031 2/20 0.36
PPP1CC P36873 2/20 0.36
SLC1A2 P43004 2/20 0.35
SLC1A1 P43005 2/20 0.35
GABRR2 P28476 1/20 0.34

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
SCHEMBL4337341 0.88 GABRR1 (0.39) GABRR1POLBTDP1APEX1KDM4E
SCHEMBL9782998 0.87 GABRR1 (0.50) GABRR1POLBTDP1APEX1KDM4E
SCHEMBL722221 0.87 GABRR1 (0.50) GABRR1POLBTDP1APEX1KDM4E
SCHEMBL2806779 0.86 PEPD (0.41) POLBTDP1APEX1KDM4EGMNN
SCHEMBL11526206 0.85 GABRR1 (0.40) GABRR1POLBTDP1APEX1KDM4E
SCHEMBL9306832 0.85 PPP5C (0.40) POLBTDP1APEX1KDM4EGMNN
SCHEMBL4469497 0.84 GABRR1 (0.43) GABRR1APEX1LMNAPMP22SLC1A2
SCHEMBL7856444 0.84 GABRR1 (0.43) GABRR1APEX1LMNAPMP22SLC1A2
SCHEMBL11278967 0.83 GABRR1 (0.39) GABRR1POLBTDP1APEX1KDM4E
SCHEMBL5070654 0.81 GABRR1 (0.46) GABRR1APEX1KDM4ELMNAPMP22

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-3431525-B1 METHOD FOR CONTROLLING POLYIMIDE BACKBONE STRUCTURE AND METHOD FOR PRODUCING POLYIMIDE MITSUBISHI GAS CHEMICAL CO (JP) 2020-11-18 EP disclosed
US-20190100622-A1 METHOD FOR CONTROLLING POLYIMIDE BACKBONE STRUCTURE AND METHOD FOR PRODUCING POLYIMIDE MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2019-04-04 US disclosed
EP-3431525-A1 METHOD FOR CONTROLLING POLYIMIDE BACKBONE STRUCTURE AND METHOD FOR PRODUCING POLYIMIDE Mitsubishi Gas Chemical Company, Inc. (JP) 2019-01-23 EP disclosed