SCHEMBL920256

SCHEMBL920256

CCOCCCCCCCOc1cc[c]cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.43
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
KCNA3 P22001 1/20 0.40
GAA P10253 1/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39
NQO1 P15559 1/20 0.38
LTA4H P09960 2/20 0.38
PLA2G4B P0C869 3/20 0.38
HDAC3 O15379 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC10 Q969S8 1/20 0.37
HDAC11 Q96DB2 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37

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
SCHEMBL921599 1.00 NR5A1 (0.43) NR5A1ALDH1A1KDM4ESMN1; SMN2KCNA3
SCHEMBL919784 1.00 NR5A1 (0.43) NR5A1ALDH1A1KDM4ESMN1; SMN2KCNA3
SCHEMBL919504 0.98 ALDH1A1 (0.43) NR5A1ALDH1A1KDM4ESMN1; SMN2KCNA3
SCHEMBL920395 0.94 SMN1; SMN2 (0.42) NR5A1ALDH1A1KDM4ESMN1; SMN2KCNA3
SCHEMBL322236 0.88 THRA (0.44) ALDH1A1KDM4ESMN1; SMN2TSHRNQO1
SCHEMBL7276161 0.87 NR5A1 (0.55) NR5A1ALDH1A1SMN1; SMN2GAATP53
SCHEMBL7861362 0.87 NR5A1 (0.55) NR5A1ALDH1A1SMN1; SMN2GAATP53
SCHEMBL2457210 0.86 KDM4E (0.45) ALDH1A1KDM4ESMN1; SMN2TSHRNQO1
SCHEMBL991126 0.85 NR5A1 (0.52) NR5A1ALDH1A1SMN1; SMN2TP53TSHR
SCHEMBL77477 0.84 NR5A1 (0.60) NR5A1ALDH1A1KDM4EGAATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 NR5A1 134/4885ALDH1A1 2743/4885KDM4E 3657/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 NR5A1 440/4885ALDH1A1 4326/4885KDM4E 3733/4885

“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.