SCHEMBL13799718

SCHEMBL13799718

CC1=NN(c2ccccc2)C(C)N1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LOX P28300 1/20 0.40
▸ LOXL3 P58215 1/20 0.40
▸ LOXL4 Q96JB6 1/20 0.40
▸ LOXL2 Q9Y4K0 1/20 0.40
▸ ALDH1A1 P00352 8/20 0.38
▸ GLA P06280 5/20 0.38
▸ HPGD P15428 5/20 0.38
▸ GAA P10253 5/20 0.38
▸ MEN1 O00255 5/20 0.38
▸ MAPT P10636 5/20 0.38
▸ KMT2A Q03164 5/20 0.38
▸ L3MBTL1 Q9Y468 3/20 0.38
▸ ATM Q13315 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ TDP1 Q9NUW8 3/20 0.37
▸ PRKCZ Q05513 1/20 0.36
▸ CES2 O00748 2/20 0.35
▸ EGFR P00533 2/20 0.35

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
SCHEMBL6029205 0.75 MAPT (0.44) ALDH1A1GLAHPGDGAAMEN1
SCHEMBL6029209 0.75 MAPT (0.44) ALDH1A1GLAHPGDGAAMEN1
SCHEMBL13387492 0.65 MAPT (0.47) LOXLOXL3LOXL4LOXL2ALDH1A1
SCHEMBL5180030 0.64 LOX (0.46) LOXLOXL3LOXL4LOXL2ALDH1A1
SCHEMBL31484357 0.62 ALDH1A1 (0.39) ALDH1A1GLAHPGDGAAMEN1
SCHEMBL14367852 0.61 MEN1 (0.66) ALDH1A1GLAHPGDGAAMEN1
SCHEMBL13048555 0.61 LOX (0.43) LOXLOXL3LOXL4LOXL2ALDH1A1
SCHEMBL8103392 0.60 MAPT (0.68) ALDH1A1GLAGAAMEN1MAPT
SCHEMBL31537146 0.60 MAPT (0.46) LOXLOXL3LOXL4LOXL2ALDH1A1
SCHEMBL7721905 0.60 L3MBTL1 (0.40) LOXLOXL3LOXL4LOXL2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8642634-B2 Fungicidal azocyclic amides E I DU PONT DE NEMOURS AND COMPANY (US) 2014-02-04 — — US disclosed
US-8642634-B2 Fungicidal azocyclic amides E I DU PONT DE NEMOURS AND COMPANY (US) 2014-02-04 — — US disclosed
US-20090156592-A1 Fungicidal Azocyclic Amides E.I. DU PONT DE NEMOURS AND COMPANY (DE) 2009-06-18 — — US disclosed
US-20090156592-A1 Fungicidal Azocyclic Amides E.I. DU PONT DE NEMOURS AND COMPANY (DE) 2009-06-18 — — 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-20090156592-A1 Fungicidal Azocyclic Amides ARG1, NAT1, CHRM1 LOX 3711/4885LOXL3 3383/4885LOXL4 4088/4885

“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.

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