SCHEMBL922705

SCHEMBL922705

Nc1ncccc1C(=O)NCc1cccc(Sc2ccccc2)c1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.63
NSD2 O96028 3/20 0.53
POLB P06746 2/20 0.49
PRKCI P41743 1/20 0.49
TP53 P04637 1/20 0.48
MAPK8 P45983 1/20 0.48
ALDH1A1 P00352 5/20 0.48
LMNA P02545 1/20 0.48
HPGD P15428 3/20 0.47
KDM4E B2RXH2 2/20 0.47
HSD17B10 Q99714 1/20 0.47
CA2 P00918 1/20 0.47
CA4 P22748 1/20 0.47
EGLN1 Q9GZT9 1/20 0.46
USP2 O75604 2/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL921595 0.89 ATM (0.67) ATMNSD2POLBPRKCIMAPK8
SCHEMBL922492 0.85 NSD2 (0.66) ATMNSD2PRKCIMAPK8LMNA
SCHEMBL920896 0.84 POLB (0.58) ATMNSD2POLBTP53ALDH1A1
SCHEMBL922032 0.84 NSD2 (0.56) ATMNSD2POLBPRKCIMAPK8
SCHEMBL923436 0.84 NSD2 (0.56) ATMNSD2POLBPRKCIMAPK8
SCHEMBL920950 0.84 NSD2 (0.56) ATMNSD2PRKCIMAPK8ALDH1A1
SCHEMBL921723 0.82 POLB (0.59) ATMPOLBALDH1A1LMNAHPGD
SCHEMBL921415 0.82 ROCK2 (0.53) ATMNSD2POLBPRKCIMAPK8
SCHEMBL27803858 0.82 NSD2 (0.52) ATMNSD2POLBPRKCIMAPK8
SCHEMBL1680406 0.81 MAPK8 (0.63) NSD2POLBMAPK8ALDH1A1HPGD

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 5 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
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
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
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 ATM 2664/4885NSD2 1533/4885POLB 4159/4885

“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.