SCHEMBL919481

SCHEMBL919481

COc1ccc(Oc2ccc[c]c2F)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
HTT P42858 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
MAPK1 P28482 1/20 0.47
LMNA P02545 2/20 0.45
GAA P10253 2/20 0.45
POLB P06746 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
LTA4H P09960 2/20 0.44
SLC6A2 P23975 1/20 0.42
SLC6A4 P31645 1/20 0.42
SLC6A3 Q01959 1/20 0.42
HPGD P15428 1/20 0.41
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39

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
SCHEMBL919101 0.87 SLC6A2 (0.42) ALDH1A1HTTL3MBTL1MAPK1LMNA
SCHEMBL920606 0.86 SLC6A4 (0.42) ALDH1A1HTTL3MBTL1MAPK1LMNA
SCHEMBL919283 0.85 MAPT (0.44) ALDH1A1L3MBTL1MAPK1LMNAPOLB
SCHEMBL920807 0.83 TSHR (0.42) ALDH1A1HTTL3MBTL1MAPK1LMNA
SCHEMBL919270 0.82 MAPT (0.43) ALDH1A1HTTCYP1A2CYP2C9CYP2C19
SCHEMBL157951 0.81
SCHEMBL920292 0.80 L3MBTL1 (0.48) ALDH1A1HTTL3MBTL1MAPK1GAA
SCHEMBL8124424 0.80 ALDH1A1 (0.48) ALDH1A1HTTL3MBTL1MAPK1LMNA
SCHEMBL8116736 0.79 L3MBTL1 (0.45) ALDH1A1HTTL3MBTL1MAPK1LMNA
SCHEMBL919788 0.79 NPC1 (0.51) RAB9A

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
CN-103119030-A Matrix metalloproteinase inhibitors RANBAXY LAB LTD 2013-05-22 CN claimed
CN-103119030-A Matrix metalloproteinase inhibitors RANBAXY LAB LTD 2013-05-22 CN disclosed
US-20110201649-A1 AGRICULTURAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-18 US disclosed
EP-2345328-A1 COMPOSITION FOR AGRICULTURAL USE Sumitomo Chemical Company, Limited (JP) 2011-07-20 EP disclosed
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
EP-2248423-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 ALDH1A1 2743/4885HTT 2561/4885L3MBTL1 1292/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 ALDH1A1 4326/4885HTT 450/4885L3MBTL1 779/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.