SCHEMBL4532403

SCHEMBL4532403

O=Cc1cn(-c2ncccn2)c2nccc(Cl)c12

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.34
TRIM33 Q9UPN9 1/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
HSP90AA1 P07900 1/20 0.33
IDO1 P14902 1/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CCR1 P32246 1/20 0.32
CCR5 P51681 1/20 0.32
CCR8 P51685 1/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
AURKA O14965 1/20 0.31
AURKB Q96GD4 1/20 0.31
GABRP O00591 1/20 0.31

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
SCHEMBL11885542 0.81 MEN1 (0.37) TRIM24TRIM33KMT2AMEN1KDM4E
SCHEMBL27791425 0.78 CCR1 (0.35) TRIM24TRIM33CCR1CCR5CCR8
SCHEMBL3690474 0.77 LMNA (0.41) KDM4ENPSR1L3MBTL1ALDH1A1MAPT
SCHEMBL18059695 0.71 AURKA (0.42) KMT2AMEN1RAB9ANPSR1L3MBTL1
SCHEMBL16967783 0.66 KDM4E (0.51) KDM4ENPSR1L3MBTL1ALDH1A1
SCHEMBL3685007 0.66 RORC (0.34) TRIM24TRIM33KDM4EALDH1A1RPS6KA5
SCHEMBL9034644 0.65 CCR1 (0.52) TRIM24TRIM33KMT2AMEN1KDM4E
SCHEMBL28551414 0.61 ALDH1A1 (0.48) KMT2AMEN1KDM4ENPC1HSP90AA1
SCHEMBL27996104 0.61 ALDH1A1 (0.48) KMT2AMEN1KDM4EALDH1A1
SCHEMBL4530465 0.61 LRRK2 (0.53) KMT2ACCR1CCR5CCR8AURKA

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-20120190680-A1 Heteroaryl Amide Analogues H. LUNDBECK A/S (DK) 2012-07-26 US disclosed
WO-2009108551-A2 HETEROARYL AMIDE ANALOGUES H. LUNDBECK A/S (DK) 2009-09-03 WO 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-20120190680-A1 Heteroaryl Amide Analogues P2RX3, P2RX2, ADORA2A TRIM24 4075/4885TRIM33 2117/4885KMT2A 2778/4885

“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.