SCHEMBL3762408

SCHEMBL3762408

O=C1NN(c2ccccc2)C(=O)/C1=C1\C(=O)Nc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
LRRK2 Q5S007 4/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
PDGFRA P16234 1/20 0.43
FER P16591 1/20 0.43
LTK P29376 1/20 0.43
CDK8 P49336 1/20 0.43
ACVR1 Q04771 1/20 0.43
DYRK1B Q9Y463 1/20 0.43
IDO1 P14902 1/20 0.43
ALDH1A1 P00352 3/20 0.40
MAPT P10636 2/20 0.40
ABL1 P00519 1/20 0.40
SRC P12931 1/20 0.40
POLB P06746 1/20 0.40
JAK2 O60674 1/20 0.38
ZAP70 P43403 1/20 0.38
SYK P43405 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
SCHEMBL3762404 1.00 MEN1 (0.44) MEN1KMT2ALRRK2MAOAMAOB
SCHEMBL3762412 1.00 MEN1 (0.44) MEN1KMT2ALRRK2MAOAMAOB
SCHEMBL15619245 0.85 ALDH1A1 (0.51) MEN1KMT2ALRRK2ALDH1A1MAPT
SCHEMBL15619244 0.85 ALDH1A1 (0.51) MEN1KMT2ALRRK2ALDH1A1MAPT
Isoindigo SCHEMBL9899736 0.78 LRRK2 (0.67) LRRK2MAOAMAOBPDGFRAFER
Isoindigo SCHEMBL9899740 0.78 LRRK2 (0.67) LRRK2MAOAMAOBPDGFRAFER
Isoindigo SCHEMBL12386233 0.78 LRRK2 (0.67) LRRK2MAOAMAOBPDGFRAFER
Isoindigo SCHEMBL29349649 0.78 LRRK2 (0.67) LRRK2MAOAMAOBPDGFRAFER
SCHEMBL2589274 0.71 LRRK2 (0.57) MEN1KMT2ALRRK2MAOAMAOB
SCHEMBL2589272 0.71 LRRK2 (0.57) MEN1KMT2ALRRK2MAOAMAOB

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-20100305121-A1 NOVEL ANTAGONISTS OF THE HUMAN FATTY ACID SYNTHASE THIOESTERASE BURHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2010-12-02 US disclosed
US-20070203236-A1 NOVEL ANTAGONISTS OF THE HUMAN FATTY ACID SYNTHASE THIOESTERASE UNITED STATES GOVERNMENT 2007-08-30 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 (2 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-20070203236-A1 NOVEL ANTAGONISTS OF THE HUMAN FATTY ACID SYNTHASE THIOESTERASE FADS2, ACOT7, FADS1 MEN1 3665/4885KMT2A 3767/4885LRRK2 4731/4885
US-20100305121-A1 NOVEL ANTAGONISTS OF THE HUMAN FATTY ACID SYNTHASE THIOESTERASE FADS2, ACOT7, FADS1 MEN1 3665/4885KMT2A 3767/4885LRRK2 4731/4885

“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.