SCHEMBL921032

SCHEMBL921032

CCOc1ccc(Oc2ccc(CNC(=O)c3ccc(F)nc3N)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
LMNA P02545 3/20 0.48
RXFP1 Q9HBX9 3/20 0.48
EPHX2 P34913 1/20 0.47
NR1H4 Q96RI1 1/20 0.47
HDAC1 Q13547 1/20 0.46
KLKB1 P03952 1/20 0.46
KLK1 P06870 1/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KDM4E B2RXH2 1/20 0.45
USP2 O75604 1/20 0.45
LIPG Q9Y5X9 1/20 0.45
NPC1 O15118 1/20 0.44
MAPK1 P28482 1/20 0.44
RAB9A P51151 1/20 0.44
TP53 P04637 3/20 0.44

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
SCHEMBL919487 0.92 KLKB1 (0.46) POLBLMNARXFP1KLKB1KLK1
SCHEMBL921454 0.91 FAAH (0.50) POLBLMNASMN1; SMN2LIPG
SCHEMBL922078 0.91 FAAH (0.45) POLBLMNAHDAC1SMN1; SMN2LIPG
SCHEMBL921095 0.91 LIPG (0.47) POLBHPGDSMN1; SMN2LIPGTP53
SCHEMBL919844 0.89 LIPG (0.45) HPGDSMN1; SMN2LIPGRAB9A
SCHEMBL920140 0.89 EGLN1 (0.51) LMNAHPGDSMN1; SMN2LIPG
SCHEMBL921316 0.89 MAPK14 (0.53) RXFP1HPGDSMN1; SMN2KDM4ELIPG
SCHEMBL919908 0.89 RXFP1 (0.47) POLBLMNARXFP1HPGDSMN1; SMN2
SCHEMBL920506 0.89 CYP3A4 (0.54) POLBLMNASMN1; SMN2LIPG
SCHEMBL922072 0.88 POLB (0.54) POLBLMNARXFP1EPHX2NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (1 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 POLB 4159/4885LMNA 4812/4885RXFP1 1712/4885

“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.