SCHEMBL13516424

SCHEMBL13516424

O=C(O)c1ccc2cccnc2c1Cl

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.68
LMNA P02545 4/20 0.54
ALOX12 P18054 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
MAPT P10636 3/20 0.51
PLEC Q15149 1/20 0.51
EGLN1 Q9GZT9 7/20 0.50
KDM4E B2RXH2 5/20 0.50
TET2 Q6N021 2/20 0.50
TET1 Q8NFU7 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
CYP3A4 P08684 2/20 0.50
ALOX15 P16050 2/20 0.50
TSHR P16473 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
GMNN O75496 1/20 0.50
TP53 P04637 1/20 0.50
HSP90AA1 P07900 1/20 0.50
MMP2 P08253 1/20 0.50
CYP2D6 P10635 1/20 0.50

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
Hydrochloric Acid SCHEMBL13516158 0.98 ALDH1A1 (0.66) ALDH1A1LMNAALOX12SMN1; SMN2MAPT
SCHEMBL13516157 0.86 ALDH1A1 (0.54) ALDH1A1LMNAALOX12SMN1; SMN2MAPT
SCHEMBL29906219 0.81 ALDH1A1 (0.70) ALDH1A1LMNAALOX12SMN1; SMN2MAPT
SCHEMBL16383149 0.81 ALDH1A1 (0.70) ALDH1A1LMNAALOX12SMN1; SMN2MAPT
SCHEMBL69869 0.81 ALDH1A1 (0.70) ALDH1A1LMNAALOX12SMN1; SMN2MAPT
SCHEMBL1759043 0.81 ALDH1A1 (1.00) ALDH1A1LMNAALOX12EGLN1KDM4E
SCHEMBL9139640 0.79 ALDH1A1 (0.97) ALDH1A1LMNAALOX12EGLN1KDM4E
SCHEMBL644794 0.79 ALDH1A1 (0.68) ALDH1A1LMNAALOX12SMN1; SMN2MAPT
SCHEMBL999633 0.79 ALDH1A1 (0.68) ALDH1A1LMNAALOX12SMN1; SMN2MAPT
SCHEMBL29749881 0.78 PARP1 (0.70) ALDH1A1LMNAALOX12SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2456759-B1 PESTICIDAL CARBOXAMIDES BAYER CROPSCIENCE AG (DE) 2017-04-19 EP disclosed
US-8822691-B2 Pesticidal carboxamides BAYER CROPSCIENCE AG (DE) 2014-09-02 US disclosed
US-20120277185-A1 Pesticidal Carboxamides BAYER CROPSCIENDE AG (DE) 2012-11-01 US 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-20120277185-A1 Pesticidal Carboxamides DDT, ACHE, AADAC ALDH1A1 1266/4885LMNA 3905/4885ALOX12 2499/4885

“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.