SCHEMBL6803727

SCHEMBL6803727

Cc1ncc(-c2cccc(NC(=O)c3cccc4c3[nH]c3ccccc34)c2)n1C

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 6/20 0.46
KMT2A Q03164 3/20 0.44
MEN1 O00255 1/20 0.44
SCN4A P35499 2/20 0.44
SCN3A Q9NY46 2/20 0.44
SCN9A Q15858 1/20 0.44
TP53 P04637 2/20 0.41
MAPT P10636 2/20 0.41
MGAM O43451 1/20 0.41
GRM5 P41594 1/20 0.41
GSK3B P49841 3/20 0.41
CLK2 P49760 1/20 0.41
CLK3 P49761 1/20 0.41
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
BRAF P15056 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL6804372 0.90 DYRK1A (0.45) DYRK1AKMT2AMEN1SCN4ASCN3A
SCHEMBL6760435 0.89 DYRK1A (0.45) DYRK1AKMT2AMEN1MAPTMGAM
SCHEMBL6756978 0.89 KMT2A (0.43) KMT2AMEN1SCN4ASCN3ASCN9A
SCHEMBL6755637 0.87 MAPT (0.45) DYRK1AKMT2AMEN1TP53MAPT
SCHEMBL6833169 0.87 DYRK1A (0.44) DYRK1AKMT2ASCN4ASCN3ASCN9A
SCHEMBL6757933 0.87 SCN4A (0.42) DYRK1AKMT2AMEN1SCN4ASCN3A
SCHEMBL6805348 0.83 DYRK1A (0.43) DYRK1AGRM5GSK3BCLK2CLK3
SCHEMBL6760168 0.80 DYRK1A (0.41) DYRK1AGRM5GSK3BCLK2CLK3
SCHEMBL6755618 0.79 DYRK1A (0.40) DYRK1AKMT2AMEN1TP53MAPT
SCHEMBL6833155 0.79 CNR1 (0.47) KMT2AMEN1SCN4ASCN3ASCN9A

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-20040266774-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-12-30 US disclosed
US-6770667-B1 N-((IMIDAZOLYL)-PHENYL)-FLUORENE-1-CARBOXAMIDE DERIVATIVES; 5-HYDROXYTRYPTAMINE (5-HT) ANTAGONISTS; PSYCHOLOGICAL, NERVOUS SYSTEM, EATING, BRAIN AND SLEEP DISORDERS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-08-03 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-20040266774-A1 Amide compounds TPH1, HTR1A, HTR5A DYRK1A 2942/4885KMT2A 2167/4885MEN1 1936/4885

“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.