SCHEMBL28620841

SCHEMBL28620841

O=C(OC(=O)c1ccc(Oc2ccccc2)cc1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 3/20 0.62
SRD5A2 P31213 4/20 0.60
SMN1; SMN2 Q16637 1/20 0.59
AKR1C3 P42330 1/20 0.55
PGR P06401 1/20 0.55
ERCC5 P28715 1/20 0.53
FEN1 P39748 1/20 0.53
F2 P00734 1/20 0.52
LMNA P02545 1/20 0.52
LTA4H P09960 2/20 0.50
TSHR P16473 1/20 0.50
POLB P06746 1/20 0.50
TNKS O95271 1/20 0.50
PARP15 Q460N3 1/20 0.50
PARP14 Q460N5 1/20 0.50
TNKS2 Q9H2K2 1/20 0.50
PARP2 Q9UGN5 1/20 0.50
NR1H2 P55055 1/20 0.50
BAX Q07812 1/20 0.50
ALDH1A1 P00352 1/20 0.50

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
SCHEMBL6892695 0.98 PARP10 (0.64) PARP10SRD5A2SMN1; SMN2AKR1C3PGR
SCHEMBL29484786 0.98 PARP10 (0.59) PARP10SRD5A2SMN1; SMN2AKR1C3PGR
SCHEMBL5323530 0.90 PARP10 (0.60) PARP10SRD5A2SMN1; SMN2AKR1C3PGR
SCHEMBL8717537 0.87 LMNA (0.67) PARP10SRD5A2SMN1; SMN2F2LMNA
SCHEMBL6938784 0.86 AKR1C3 (0.70) PARP10SMN1; SMN2AKR1C3ERCC5FEN1
SCHEMBL52413 0.84 LMNA (0.70) PARP10SMN1; SMN2F2LMNATSHR
Hydrogen Peroxide SCHEMBL27952375 0.84 LMNA (0.70) PARP10SMN1; SMN2F2LMNATSHR
Benzene SCHEMBL27793442 0.84 LMNA (0.70) PARP10SMN1; SMN2F2LMNATSHR
SCHEMBL6938778 0.84 AKR1C3 (0.72) PARP10SMN1; SMN2AKR1C3ERCC5FEN1
SCHEMBL16174814 0.83 SMN1; SMN2 (0.55) PARP10SRD5A2SMN1; SMN2ERCC5FEN1

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
CN-113272270-B Method for producing 1, 4-bis (4-phenoxybenzoyl) benzene at elevated temperature 阿科玛法国公司 2024-04-16 CN disclosed
CN-113272270-A Process for the manufacture of 1, 4-bis (4-phenoxybenzoyl) benzene at elevated temperature 阿科玛法国公司 2021-08-17 CN disclosed