SCHEMBL4445659

SCHEMBL4445659

C=C(CC(CCCC)CS(=O)(=O)O)C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.38
CA2 P00918 5/20 0.36
CA1 P00915 2/20 0.36
TP53 P04637 1/20 0.35
TSHR P16473 2/20 0.33
DPP7 Q9UHL4 1/20 0.32
ALDH1A1 P00352 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
CYP3A4 P08684 1/20 0.31
ATM Q13315 1/20 0.31
MAPK1 P28482 1/20 0.30

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
SCHEMBL2409294 0.83
SCHEMBL234394 0.82 CA2 (0.46) RECQLCA2CA1TP53TSHR
SCHEMBL10591451 0.82 CA2 (0.41) RECQLCA2CA1TSHRDPP7
SCHEMBL6660249 0.78
SCHEMBL31544523 0.77 ALDH1A1 (0.44) RECQLCA2CA1TP53TSHR
SCHEMBL1567660 0.77 CACNA2D1 (0.32)
SCHEMBL2333568 0.77 LMNA (0.39) CA2CA1TP53
SCHEMBL23752256 0.74 ALDH1A1 (0.52) RECQLCA2CA1TP53TSHR
SCHEMBL438255 0.74 ALDH1A1 (0.52) RECQLCA2CA1TP53TSHR
SCHEMBL16512 0.73 TDP1 (0.31) TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090136820-A1 PROTON EXCHANGE MEMBRANE AND MEMBRANE-ELECTRODE ASSEMBLY (MEA), METHOD FOR THEIR PRODUCTION AND FUEL CELL USING SAID MEMBRANE OR ASSEMBLY STMICROELECTRONICS S.R.L. (IT) 2009-05-28 US claimed
CN-117585963-A Shrinkage-reducing anti-cracking type large-volume concrete and preparation method thereof 中建商品混凝土有限公司 2024-02-23 CN disclosed
US-20090136820-A1 PROTON EXCHANGE MEMBRANE AND MEMBRANE-ELECTRODE ASSEMBLY (MEA), METHOD FOR THEIR PRODUCTION AND FUEL CELL USING SAID MEMBRANE OR ASSEMBLY STMICROELECTRONICS S.R.L. (IT) 2009-05-28 US disclosed
EP-0488744-B1 Electrophotographic toner for negative charging MITA INDUSTRIAL CO LTD (JP) 1996-07-17 EP disclosed
US-5212033-A Electrophotographic toner for negative charging MITA INDUSTRIAL CO., LTD. (JP) 1993-05-18 US disclosed
EP-0488744-A1 Electrophotographic toner for negative charging MITA INDUSTRIAL CO., LTD. (JP) 1992-06-03 EP disclosed