SCHEMBL6248795

SCHEMBL6248795

CCCCCCCCCCC(C(=O)O)c1ccccc1[N+](=O)[O-]

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.62
TSHR P16473 1/20 0.62
ALDH1A1 P00352 1/20 0.46
HPGD P15428 2/20 0.45
GAA P10253 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
LMNA P02545 1/20 0.43
TP53 P04637 1/20 0.43
HSP90AA1 P07900 1/20 0.43
ATM Q13315 1/20 0.43
CYSLTR2 Q9NS75 1/20 0.40
CYSLTR1 Q9Y271 1/20 0.40
PLK1 P53350 1/20 0.40
PLK3 Q9H4B4 1/20 0.40
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL2299563 1.00 CYP1A2 (0.62) CYP1A2TSHRALDH1A1HPGDGAA
SCHEMBL2299567 1.00 CYP1A2 (0.62) CYP1A2TSHRALDH1A1HPGDGAA
SCHEMBL3847842 1.00 CYP1A2 (0.62) CYP1A2TSHRALDH1A1HPGDGAA
SCHEMBL6248802 1.00 CYP1A2 (0.62) CYP1A2TSHRALDH1A1HPGDGAA
SCHEMBL10350758 1.00 CYP1A2 (0.62) CYP1A2TSHRALDH1A1HPGDGAA
SCHEMBL3660414 1.00 CYP1A2 (0.62) CYP1A2TSHRALDH1A1HPGDGAA
SCHEMBL3663769 1.00 CYP1A2 (0.62) CYP1A2TSHRALDH1A1HPGDGAA
SCHEMBL4609123 1.00 CYP1A2 (0.62) CYP1A2TSHRALDH1A1HPGDGAA
SCHEMBL4609132 1.00 CYP1A2 (0.62) CYP1A2TSHRALDH1A1HPGDGAA
SCHEMBL3847837 1.00 CYP1A2 (0.62) CYP1A2TSHRALDH1A1HPGDGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107090486-B Articles and methods for detecting target microorganisms 3M创新有限公司 2021-09-03 CN disclosed
EP-3341458-A1 DETERGENT COMPOSITIONS WITH LIPASE AND BIOSURFACTANT Unilever PLC (GB) 2018-07-04 EP disclosed
EP-3341459-A1 IMPROVED WASH COMPOSITIONS Unilever Plc. (GB) 2018-07-04 EP disclosed
WO-2017036901-A1 IMPROVED WASH COMPOSITIONS UNILEVER PLC (GB) 2017-03-09 WO disclosed
WO-2017036902-A1 DETERGENT COMPOSITIONS WITH LIPASE AND BIOSURFACTANT UNILEVER PLC (GB) 2017-03-09 WO disclosed
WO-2005040334-A2 SELECTIVE LIPASES AND METHODS OF SCREENING THEREFOR ENZYMOTEC LTD. (IL) 2005-05-06 WO disclosed
US-4326009-A Polymeric particulate carrier ROYER GARFIELD P 1982-04-20 US disclosed