SCHEMBL2897540

SCHEMBL2897540

CCC(C)C(=O)Nc1c[c]ccc1OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.50
KMT2A Q03164 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
ALDH1A1 P00352 5/20 0.47
LMNA P02545 3/20 0.47
TSHR P16473 1/20 0.43
HSD17B10 Q99714 1/20 0.43
RAB9A P51151 2/20 0.42
MAPT P10636 3/20 0.40
MEN1 O00255 2/20 0.40
GAA P10253 2/20 0.40
HTT P42858 2/20 0.40
MAPK1 P28482 1/20 0.40
HPGD P15428 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NPC1 O15118 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39

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
SCHEMBL2902879 0.85 HTT (0.46) KDM4EKMT2AALDH1A1TSHRHSD17B10
SCHEMBL2902784 0.82 KDM4E (0.48) KDM4EKMT2AL3MBTL1ALDH1A1LMNA
SCHEMBL1355211 0.80 KMT2A (0.52) KDM4EKMT2AL3MBTL1ALDH1A1LMNA
SCHEMBL2899236 0.80 HTT (0.55) KDM4EKMT2AL3MBTL1ALDH1A1RAB9A
SCHEMBL12125175 0.80 KMT2A (0.76) KDM4EKMT2AL3MBTL1ALDH1A1TSHR
SCHEMBL3002053 0.79 ALDH1A1 (0.51) KDM4EKMT2AL3MBTL1ALDH1A1LMNA
SCHEMBL1355596 0.77 ALDH1A1 (0.45) KDM4EKMT2AL3MBTL1ALDH1A1LMNA
SCHEMBL2900768 0.77 LMNA (0.49) L3MBTL1ALDH1A1LMNAGAAHTT
SCHEMBL2894992 0.77 SMN1; SMN2 (0.48) KDM4EKMT2AL3MBTL1ALDH1A1RAB9A
SCHEMBL2902630 0.75 KMT2A (0.58) KMT2AALDH1A1LMNATSHRMEN1

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-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides BAYER CROPSCIENCE AG (DE) 2010-12-02 US disclosed
EP-2236505-A1 Acylated aminopyridines and pyridazines as insecticides Bayer CropScience AG (DE) 2010-10-06 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-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides AAAS, DDT, QDPR KDM4E 762/4885KMT2A 412/4885L3MBTL1 1263/4885

“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.