SCHEMBL921595

SCHEMBL921595

Nc1ncccc1C(=O)NCc1ccc(Sc2ccccc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.67
NSD2 O96028 2/20 0.53
PRKCI P41743 1/20 0.52
ALDH1A1 P00352 3/20 0.52
KMT2A Q03164 3/20 0.51
MAPK8 P45983 1/20 0.51
HPGD P15428 2/20 0.50
APEX1 P27695 1/20 0.50
POLB P06746 2/20 0.49
EGLN1 Q9GZT9 1/20 0.48
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MAPK1 P28482 1/20 0.47
KDM4E B2RXH2 1/20 0.47
NAPRT Q6XQN6 1/20 0.47

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
SCHEMBL922705 0.89 ATM (0.63) ATMNSD2PRKCIALDH1A1KMT2A
SCHEMBL922492 0.88 NSD2 (0.66) ATMNSD2PRKCIKMT2AMAPK8
SCHEMBL920896 0.88 POLB (0.58) ATMNSD2ALDH1A1KMT2AHPGD
SCHEMBL923664 0.87 ALDH1A1 (0.69) ATMALDH1A1KMT2AHPGDPOLB
SCHEMBL13070253 0.86 ATM (0.54) ATMNSD2PRKCIALDH1A1KMT2A
SCHEMBL922251 0.86 GALR3 (0.60) ATMNSD2PRKCIKMT2AMAPK8
SCHEMBL922488 0.86 NSD2 (0.60) ATMNSD2PRKCIALDH1A1KMT2A
SCHEMBL921723 0.85 POLB (0.59) ATMALDH1A1KMT2AHPGDAPEX1
SCHEMBL921272 0.83 MT-CO2 (0.54) ATMNSD2PRKCIALDH1A1KMT2A
SCHEMBL27824616 0.83 NSD2 (0.56) ATMNSD2PRKCIALDH1A1KMT2A

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-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

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 1533/4885PRKCI 3037/4885

“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.