SCHEMBL11986229

SCHEMBL11986229

Cc1cc2nc(C#N)ccc2c(I)c1C

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.41
MDM4 O15151 1/20 0.33
CTSB P07858 2/20 0.33
TSHR P16473 1/20 0.33
HBB P68871 1/20 0.33
HSD17B10 Q99714 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CAMKK2 Q96RR4 1/20 0.32
NOS3 P29474 4/20 0.32
NOS1 P29475 4/20 0.32
MEN1 O00255 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL11986212 0.85 NQO1 (0.44) NQO1MDM4CTSBTSHRHBB
SCHEMBL11986214 0.81 NQO1 (0.41) NQO1MDM4CTSBTSHRHBB
SCHEMBL11986218 0.81 NQO1 (0.41) NQO1MDM4CTSBTSHRHBB
SCHEMBL11985978 0.78 POLB (0.42) KMT2AKDM4EALDH1A1POLB
SCHEMBL11985976 0.78 POLB (0.34) L3MBTL1POLB
SCHEMBL11985974 0.75 POLB (0.40) KDM4EALDH1A1POLB
SCHEMBL11985975 0.75 POLB (0.33) POLB
SCHEMBL10272346 0.75 POLB (0.33) POLB
SCHEMBL25314520 0.72 NQO2 (0.44) NQO1MDM4TSHRHBBHSD17B10
SCHEMBL11986223 0.71 GRM2 (0.36) MDM4NOS3NOS1KMT2AKDM4E

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-8247431-B2 Heterocyclic hydrazide compound and pesticidal use of the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-21 US disclosed
US-20100137362-A1 HETEROCYCLIC HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-06-03 US 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-20100137362-A1 HETEROCYCLIC HYDRAZIDE COMPOUND AND PESTICIDAL USE OF THE SAME ACHE, CAT, DNPH1 NQO1 5/4885MDM4 4631/4885CTSB 1648/4885

“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.