SCHEMBL370540

SCHEMBL370540

COC(=O)c1[nH]c(I)nc1C

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.40
KDM4C Q9H3R0 1/20 0.38
TSHR P16473 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ALDH1A1 P00352 6/20 0.34
LMNA P02545 4/20 0.34
KDM4E B2RXH2 4/20 0.34
HPGD P15428 3/20 0.34
MAPT P10636 2/20 0.34
MAPK1 P28482 2/20 0.34
TP53 P04637 1/20 0.34
HSD17B10 Q99714 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
GAA P10253 2/20 0.33
HTT P42858 1/20 0.33
PADI4 Q9UM07 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33

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
SCHEMBL4604695 0.81 ALDH1A1 (0.50) TSHRL3MBTL1ALDH1A1LMNAKDM4E
SCHEMBL21242693 0.80 KDM4E (0.41) NPSR1KDM4CTSHRL3MBTL1ALDH1A1
SCHEMBL24284346 0.80 NPSR1 (0.43) NPSR1KDM4CTSHRL3MBTL1ALDH1A1
SCHEMBL4607159 0.74 LMNA (0.41) NPSR1KDM4CL3MBTL1ALDH1A1LMNA
SCHEMBL17362945 0.73 KDM4E (0.41) NPSR1KDM4CTSHRL3MBTL1ALDH1A1
SCHEMBL4607219 0.69 ERCC1 (0.56) TSHRALDH1A1LMNAKDM4EHPGD
SCHEMBL169816 0.69 KDM4C (0.50) NPSR1KDM4CTSHRALDH1A1LMNA
SCHEMBL30483935 0.68 NPSR1 (0.50) NPSR1KDM4CTSHRL3MBTL1ALDH1A1
SCHEMBL17362511 0.67 CYP1A2 (0.40) NPSR1KDM4CTSHRL3MBTL1ALDH1A1
SCHEMBL14736371 0.67 NPSR1 (0.52) NPSR1KDM4CTSHRL3MBTL1ALDH1A1

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-9233951-B2 Heterocyclic compounds as pesticides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-01-12 US disclosed
EP-2593447-A2 NEW HETEROCYCLIC COMPOUNDS AS PESTICIDES Bayer Intellectual Property GmbH (DE) 2013-05-22 EP disclosed
US-20120094837-A1 Novel Heterocyclic Compounds as Pesticides BAYER CROP SCIENCE AG (DE) 2012-04-19 US disclosed
WO-2012007500-A2 NEW HETEROCYCLIC COMPOUNDS AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2012-01-19 WO 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-20120094837-A1 Novel Heterocyclic Compounds as Pesticides DDT, PTMS, ACHE NPSR1 1287/4885KDM4C 273/4885TSHR 2870/4885

“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.