SCHEMBL3690474

SCHEMBL3690474

O=C(O)c1cn(-c2ncccn2)c2nccc(Cl)c12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
RORC P51449 5/20 0.41
DHODH Q02127 1/20 0.39
CYP2C9 P11712 1/20 0.38
KDM4E B2RXH2 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
PKM P14618 1/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
CYP3A4 P08684 1/20 0.36
ALOX15 P16050 1/20 0.36
TSHR P16473 1/20 0.36
BLM P54132 1/20 0.36
AGER Q15109 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
KDM5A P29375 1/20 0.35
KDM4C Q9H3R0 1/20 0.35
CLCN2 P51788 1/20 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
SCHEMBL3645958 0.80 RORC (0.43) LMNASMN1; SMN2RORCDHODHCYP2C9
SCHEMBL22554085 0.78 KDM4C (0.40) LMNASMN1; SMN2DHODHCYP2C9KDM4E
SCHEMBL31277771 0.78 KDM5A (0.38) LMNASMN1; SMN2RORCDHODHKDM4E
SCHEMBL4532403 0.77 TRIM24 (0.34) KDM4EALDH1A1MAPTNPSR1L3MBTL1
SCHEMBL11026570 0.74 P2RX7 (0.54)
SCHEMBL4535427 0.74 P2RX7 (0.54)
SCHEMBL18059687 0.74 AURKA (0.41) LMNASMN1; SMN2RORCCYP2C9KDM4E
SCHEMBL13706794 0.73 P2RX7 (0.48) KDM4EPKMTSHR
SCHEMBL4534000 0.73 P2RX7 (0.43) KDM4EPKMALDH1A1TSHR
SCHEMBL4528212 0.73 P2RX7 (0.42)

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-20120190680-A1 Heteroaryl Amide Analogues H. LUNDBECK A/S (DK) 2012-07-26 US disclosed
EP-2185560-A1 HETEROARYL AMIDE ANALOGUES H. Lundbeck A/S (DK) 2010-05-19 EP disclosed
WO-2009108551-A2 HETEROARYL AMIDE ANALOGUES H. LUNDBECK A/S (DK) 2009-09-03 WO disclosed
WO-2009023623-A1 HETEROARYL AMIDE ANALOGUES H, LUNDBECK A/S (DK) 2009-02-19 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 LMNA 4100/4885SMN1; SMN2 2327/4885RORC 635/4885

“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.