SCHEMBL22456740

SCHEMBL22456740

CP(C)(=O)c1ccc2c(c1)c1ccccc1c1nc3ccc(-c4ccc(C#N)cc4)cc3n21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.38
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
ATM Q13315 1/20 0.37
PTGER4 P35408 1/20 0.36
CHEK1 O14757 1/20 0.36
ALDH1A1 P00352 3/20 0.33
KDM4E B2RXH2 2/20 0.33
MAP4K4 O95819 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
ACP1 P24666 1/20 0.32
HPGD P15428 2/20 0.32
ACSS2 Q9NR19 1/20 0.32
PGR P06401 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A3 P47895 1/20 0.32
PRF1 P14222 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
PIK3CD O00329 1/20 0.32

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
SCHEMBL22456754 0.94 ADORA2A (0.39) ADORA2AKMT2AMEN1ATMPTGER4
SCHEMBL22456752 0.93 CHEK1 (0.41) ADORA2AKMT2AMEN1ATMPTGER4
SCHEMBL22456753 0.90 PTGER4 (0.37) ADORA2AKMT2AMEN1ATMPTGER4
SCHEMBL22456743 0.88 CHEK1 (0.38) ADORA2AKMT2AMEN1ATMPTGER4
SCHEMBL22456755 0.87 ADORA2A (0.41) ADORA2AKMT2AMEN1ATMCHEK1
SCHEMBL22456811 0.84 ADORA2A (0.38) ADORA2AKMT2AALDH1A1KDM4EACP1
SCHEMBL22456454 0.84 ALDH1A1 (0.41) KMT2AMEN1ALDH1A1KDM4EGAA
SCHEMBL22456746 0.83 ADORA2A (0.41) ADORA2AACP1
SCHEMBL22456809 0.82 ALDH1A1 (0.42) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL22456393 0.80 KDM4E (0.43) KMT2AMEN1ALDH1A1KDM4EGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200303661-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LG CHEM, LTD. (KR) 2020-09-24 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-20200303661-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME NR2E3, NR2E1, NOX1 ADORA2A 1858/4885KMT2A 3190/4885MEN1 936/4885

“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.