SCHEMBL2900696

SCHEMBL2900696

CCC(=O)Nc1c[c]ccc1C

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
MAPT P10636 1/20 0.47
GFER P55789 1/20 0.47
PKM P14618 2/20 0.43
LMNA P02545 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HTT P42858 1/20 0.41
HPGD P15428 3/20 0.41
ALOX12 P18054 1/20 0.41
KDM4E B2RXH2 4/20 0.41
RAB9A P51151 3/20 0.41
GAA P10253 2/20 0.41
NPC1 O15118 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
POLB P06746 1/20 0.41
MITF O75030 1/20 0.40
TP53 P04637 1/20 0.40

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
SCHEMBL11323383 0.89 ALDH1A1 (0.50) ALDH1A1MAPTGFERPKMLMNA
SCHEMBL2896689 0.86 POLB (0.56) ALDH1A1MAPTPKMLMNAHTT
SCHEMBL2897483 0.81 ALDH1A1 (0.57) ALDH1A1MAPTLMNAHTTHPGD
SCHEMBL2899236 0.80 HTT (0.55) ALDH1A1MAPTL3MBTL1HTTKDM4E
SCHEMBL220305 0.79 ALDH1A1 (0.57) ALDH1A1MAPTPKML3MBTL1HTT
SCHEMBL2902784 0.77 KDM4E (0.48) ALDH1A1MAPTLMNAL3MBTL1HPGD
SCHEMBL221320 0.77 HDAC3 (0.48) ALDH1A1
SCHEMBL10962786 0.76 HPGD (0.50) ALDH1A1MAPTPKMLMNAHTT
SCHEMBL2901793 0.76 ALDH1A1 (0.45) ALDH1A1PKML3MBTL1HPGDKDM4E
SCHEMBL5217967 0.76 KMT2A (0.42) ALDH1A1MAPTLMNAHTTHPGD

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 ALDH1A1 551/4885MAPT 3480/4885GFER 868/4885

“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.