SCHEMBL852741

SCHEMBL852741

CCCCCCCCC(CCCCCC)Cc1cc(C)ccc1S(=O)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.38
PDE5A O76074 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
LMNA P02545 2/20 0.34
TP53 P04637 2/20 0.34
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
ALDH1A1 P00352 3/20 0.34
KDM4E B2RXH2 2/20 0.33
HPGD P15428 2/20 0.33
S1PR3 Q99500 2/20 0.33
MCHR1 Q99705 1/20 0.33
CA2 P00918 1/20 0.33
S1PR2 O95136 1/20 0.33
S1PR1 P21453 1/20 0.33
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL28738383 1.00 POLB (0.38) POLBPDE5AL3MBTL1LMNATP53
SCHEMBL3244574 0.89 TSHR (0.36) POLBL3MBTL1LMNAALDH1A1KDM4E
SCHEMBL10486656 0.87 POLB (0.39) POLBPDE5AL3MBTL1LMNATP53
SCHEMBL8496554 0.87 POLB (0.39) POLBPDE5AL3MBTL1LMNATP53
SCHEMBL6968752 0.87 POLB (0.39) POLBPDE5AL3MBTL1LMNATP53
SCHEMBL7091694 0.87 POLB (0.39) POLBPDE5AL3MBTL1LMNATP53
SCHEMBL9562134 0.87 POLB (0.39) POLBPDE5AL3MBTL1LMNATP53
SCHEMBL6971807 0.87 POLB (0.39) POLBPDE5AL3MBTL1LMNATP53
SCHEMBL7786035 0.86 S1PR3 (0.42) POLBLMNATP53PRSS1PRSS2
SCHEMBL28480189 0.86 POLB (0.38) POLBPDE5AL3MBTL1LMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114787219-A Non-blended amphiphilic thermoplastic polyurethanes, methods of making the same, and implantable medical devices comprising the same 爱-森新株式会社 2022-07-22 CN disclosed
US-20160185968-A1 ORGANIC DYES HAVING RIGID DONOR, PROCESS FOR PRODUCING THE SAME, AND DYE-SENSITIZED SOLAR CELL CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY CHINESE ACADEMY OF SCIENCES (CN) 2016-06-30 US disclosed
US-9376567-B1 Organic dyes having rigid donor, process for producing the same, and dye-sensitized solar cell CHANGCHUN INSTITUTE OF APPLIED CHEMISTRY CHINESE ACADEMY OF SCIENCES (CN) 2016-06-28 US disclosed
EP-2432817-B1 CONJUGATED POLYMERS AND THEIR USE IN OPTOELECTRONIC DEVICES RAYNERGY TEK INC (TW) 2015-02-11 EP disclosed
US-8748739-B2 Conjugated polymers and their use in optoelectronic devices POLYERA CORPORATION (US) 2014-06-10 US disclosed
US-20130098448-A1 Conjugated Polymers and Their Use in Optoelectronic Devices RAYNERGY TEK INC. (TW) 2013-04-25 US disclosed
US-8334456-B2 Conjugated polymers and their use in optoelectronic devices POLYERA CORPORATION (US) 2012-12-18 US disclosed
EP-2432817-A1 CONJUGATED POLYMERS AND THEIR USE IN OPTOELECTRONIC DEVICES Polyera Corporation (US) 2012-03-28 EP disclosed
US-20100307594-A1 Conjugated Polymers and Their Use in Optoelectronic Devices RAYNERGY TEK INC. (TW) 2010-12-09 US disclosed
WO-2010135701-A1 CONJUGATED POLYMERS AND THEIR USE IN OPTOELECTRONIC DEVICES POLYERA CORPORATION (US) 2010-11-25 WO disclosed