SCHEMBL31060067

SCHEMBL31060067

CCOC(=O)c1cc(OCC)nn1-c1ncccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
SMN1; SMN2 Q16637 4/20 0.42
PDE4B Q07343 2/20 0.42
HSD11B1 P28845 1/20 0.41
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
POLB P06746 2/20 0.39
KDM4E B2RXH2 3/20 0.39
MAPT P10636 2/20 0.39
PDE4A P27815 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
KCNH2 Q12809 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
MAPK1 P28482 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KMT2A Q03164 1/20 0.38
ATM Q13315 1/20 0.38
JMJD6 Q6NYC1 1/20 0.38

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
SCHEMBL25702840 0.92 SMN1; SMN2 (0.49) ALDH1A1SMN1; SMN2PDE4BHSD11B1NPC1
SCHEMBL30234432 0.92 SMN1; SMN2 (0.49) ALDH1A1SMN1; SMN2PDE4BHSD11B1NPC1
SCHEMBL3190767 0.90 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2PDE4BHSD11B1NPC1
SCHEMBL1762653 0.89 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2PDE4BHSD11B1NPC1
SCHEMBL16014641 0.89 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2PDE4BHSD11B1NPC1
SCHEMBL1762446 0.88 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2PDE4BHSD11B1NPC1
SCHEMBL951462 0.88 SMN1; SMN2 (0.52) ALDH1A1SMN1; SMN2PDE4BHSD11B1NPC1
SCHEMBL16014505 0.88 NPC1 (0.40) ALDH1A1NPC1RAB9AKDM4EMAPT
SCHEMBL29558577 0.88 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2PDE4BHSD11B1NPC1
SCHEMBL29860005 0.87 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2PDE4BHSD11B1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240308988-A1 Method For Controlling Diamide Resistant Pests and Compounds Therefor SYNGENTA CROP PROTECTION AG (CH) 2024-09-19 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-20240308988-A1 Method For Controlling Diamide Resistant Pests and Compounds Therefor DDT, NOS1, SLC11A2 ALDH1A1 784/4885SMN1; SMN2 2224/4885PDE4B 837/4885

“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.