SCHEMBL8694528

SCHEMBL8694528

CCCCCCCCCCCCc1cccc2c1C(=O)c1ccccc1C2=O.[NaH]

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.56
CTSG P08311 4/20 0.56
NR1H2 P55055 1/20 0.52
NR1H3 Q13133 1/20 0.52
PTPN1 P18031 1/20 0.51
LIPG Q9Y5X9 1/20 0.46
NSD2 O96028 1/20 0.46
ALDH1A1 P00352 1/20 0.46
EGFR P00533 1/20 0.46
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
MAPK1 P28482 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CYSLTR2 Q9NS75 3/20 0.45
CYSLTR1 Q9Y271 3/20 0.45
BID P55957 3/20 0.43
MCL1 Q07820 3/20 0.43
BCL2L1 Q07817 2/20 0.43
BAK1 Q16611 2/20 0.43

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
SCHEMBL1053180 0.98 ELANE (0.57) ELANECTSGNR1H2NR1H3PTPN1
SCHEMBL28036577 0.98 ELANE (0.57) ELANECTSGNR1H2NR1H3PTPN1
SCHEMBL8694531 0.97 ELANE (0.56) ELANECTSGNR1H2NR1H3PTPN1
Anthraquinone SCHEMBL27877074 0.97 ELANE (0.56) ELANECTSGNR1H2NR1H3PTPN1
SCHEMBL486105 0.97 ELANE (0.56) ELANECTSGNR1H2NR1H3PTPN1
SCHEMBL30389447 0.97 ELANE (0.56) ELANECTSGNR1H2NR1H3PTPN1
Ethane SCHEMBL28747872 0.95 ELANE (0.55) ELANECTSGNR1H2NR1H3PTPN1
Hydrogen Peroxide SCHEMBL27721287 0.94 ELANE (0.57) ELANECTSGNR1H2NR1H3PTPN1
SCHEMBL127114 0.92 ELANE (0.55) ELANECTSGNR1H2NR1H3PTPN1
SCHEMBL12096345 0.90 ELANE (0.62) ELANECTSGNR1H2NR1H3PTPN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5746917-A Strongly alkaline anion exchange membranes and process for producing the same ALTMEIER PATRICK (DE) 1998-05-05 US disclosed