SCHEMBL12495038

SCHEMBL12495038

CCOC(=O)c1cc(I)c(N)cc1CC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.50
HSD17B10 Q99714 5/20 0.50
GAA P10253 4/20 0.49
MAPK1 P28482 1/20 0.49
TSHR P16473 2/20 0.44
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
CA12 O43570 3/20 0.41
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA7 P43166 3/20 0.41
CA9 Q16790 3/20 0.41
CA14 Q9ULX7 3/20 0.41
KDM4E B2RXH2 5/20 0.41
HPGD P15428 2/20 0.41
LMNA P02545 3/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAOA P21397 1/20 0.41
MAPT P10636 4/20 0.41

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
SCHEMBL1817672 0.83 CA1 (0.51) ALDH1A1HSD17B10GAAMAPK1TSHR
SCHEMBL15272024 0.81 ALDH1A1 (0.47) ALDH1A1HSD17B10GAAMAPK1TSHR
SCHEMBL12685916 0.76 ALDH1A1 (0.49) ALDH1A1HSD17B10GAAMAPK1TSHR
SCHEMBL7471868 0.75 ALDH1A1 (0.63) ALDH1A1HSD17B10GAAMAPK1TSHR
SCHEMBL1680683 0.74 KDM4E (0.56) ALDH1A1HSD17B10GAAMAPK1TSHR
SCHEMBL7592447 0.73 TDP1 (0.48) ALDH1A1HSD17B10GAAMAPK1TSHR
SCHEMBL11784914 0.73 LMNA (0.56) ALDH1A1HSD17B10GAAMAPK1TSHR
SCHEMBL4627602 0.73 TSHR (0.59) ALDH1A1HSD17B10GAAMAPK1TSHR
SCHEMBL3666786 0.72 LMNA (0.59) ALDH1A1HSD17B10GAAKMT2AMEN1
SCHEMBL2391916 0.72 CFTR (0.59) ALDH1A1HSD17B10GAATSHRCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103502216-B As pesticide and acaricidal indole carboxamides and benzimidazole-carboxamide BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-05-04 CN disclosed
US-9107411-B2 Indolecarboxamides and benzimidazolecarboxamides as insecticides and acaricides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-08-18 US disclosed
EP-2683688-B1 INDOLECARBOXAMIDES AND BENZIMIDAZOLECARBOXAMIDES AS INSECTICIDES AND ACARICIDES BAYER IP GMBH (DE) 2015-05-06 EP disclosed
US-20140088167-A1 INDOLECARBOXAMIDES AND BENZIMIDAZOLECARBOXAMIDES AS INSECTICIDES AND ACARICIDES BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-03-27 US disclosed
EP-2683688-A1 INDOLECARBOXAMIDES AND BENZIMIDAZOLECARBOXAMIDES AS INSECTICIDES AND ACARICIDES Bayer Intellectual Property GmbH (DE) 2014-01-15 EP disclosed
CN-103502216-A Indolecarboxamides and benzimidazolecarboxamides as insecticides and acaricides BAYER IP GMBH 2014-01-08 CN disclosed
WO-2012119984-A1 INDOLECARBOXAMIDES AND BENZIMIDAZOLECARBOXAMIDES AS INSECTICIDES AND ACARICIDES BAYER CROPSCIENCE AG (DE) 2012-09-13 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-20140088167-A1 INDOLECARBOXAMIDES AND BENZIMIDAZOLECARBOXAMIDES AS INSECTICIDES AND ACARICIDES AADAC, DDT, AANAT ALDH1A1 733/4885HSD17B10 3430/4885GAA 782/4885

“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.