SCHEMBL2900768

SCHEMBL2900768

CCCC(=O)Nc1c[c]ccc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
ALDH1A1 P00352 3/20 0.47
POLB P06746 2/20 0.47
MTNR1B P49286 2/20 0.46
MAPK1 P28482 1/20 0.45
NPSR1 Q6W5P4 2/20 0.44
HTT P42858 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44

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
SCHEMBL2899236 0.88 HTT (0.55) GAATDP1L3MBTL1ALDH1A1POLB
SCHEMBL2902630 0.84 KMT2A (0.58) LMNAGAAALDH1A1POLBNPSR1
SCHEMBL2896689 0.81 POLB (0.56) LMNAGAAALDH1A1POLBMAPK1
SCHEMBL3002053 0.81 ALDH1A1 (0.51) LMNAGAAL3MBTL1ALDH1A1POLB
SCHEMBL1355596 0.80 ALDH1A1 (0.45) LMNAGAAL3MBTL1ALDH1A1MAPK1
SCHEMBL1355211 0.79 KMT2A (0.52) LMNAGAAL3MBTL1ALDH1A1MTNR1B
SCHEMBL3001126 0.79 MEN1 (0.60) LMNAGAAL3MBTL1ALDH1A1POLB
SCHEMBL5183678 0.78 ALDH1A1 (0.72) LMNAGAAL3MBTL1ALDH1A1POLB
SCHEMBL30738420 0.78 ALDH1A1 (0.72) LMNAGAAL3MBTL1ALDH1A1POLB
SCHEMBL2897540 0.77 KDM4E (0.50) LMNAGAATDP1L3MBTL1ALDH1A1

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 LMNA 2262/4885GAA 2373/4885TDP1 1244/4885

“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.