SCHEMBL2900804

SCHEMBL2900804

CCCCSCc1cc[c]cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
LMNA P02545 4/20 0.35
MAPT P10636 3/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP2C19 P33261 3/20 0.32
CYP1A2 P05177 2/20 0.32
CYP2C9 P11712 2/20 0.32
TSHR P16473 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
TP53 P04637 1/20 0.32
ALOX12 P18054 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TYR P14679 1/20 0.31
RECQL P46063 1/20 0.31

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
SCHEMBL7990823 0.94 TYR (0.36) LMNAMAPTALDH1A1CYP2C9HSD17B10
SCHEMBL11598762 0.92 ESR1 (0.36) LMNAMAPTCYP2C9HSD17B10TP53
SCHEMBL2893934 0.88 CYP2C19 (0.34) LMNAALDH1A1CYP2C19CYP1A2CYP2C9
SCHEMBL8019398 0.85 LMNA (0.42) KDM4ETDP1LMNAMAPTALDH1A1
SCHEMBL16892522 0.82 HSD17B10 (0.37) KDM4ELMNAMAPTALDH1A1TSHR
SCHEMBL27486987 0.81 HSD17B10 (0.40) KDM4ELMNAMAPTALDH1A1TSHR
SCHEMBL2561339 0.79 CYP2C19 (0.52) KDM4ETDP1LMNAMAPTALDH1A1
SCHEMBL8999593 0.79 TYR (0.41) KDM4ELMNAMAPTALDH1A1CYP2C9
SCHEMBL2903054 0.79
SCHEMBL29281816 0.78 RECQL (0.50) KDM4ELMNAMAPTALDH1A1HTT

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 762/4885TDP1 1244/4885LMNA 2262/4885

“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.