SCHEMBL22456809

SCHEMBL22456809

CP(C)(=O)c1ccc2nc3c4ccccc4c4ccc(-c5ccccc5)cc4n3c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
HPGD P15428 4/20 0.42
KDM4E B2RXH2 4/20 0.42
KMT2A Q03164 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPT P10636 2/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
POLB P06746 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PDE2A O00408 3/20 0.36
MEN1 O00255 1/20 0.35
NPM1 P06748 1/20 0.35
ALK Q9UM73 1/20 0.35
RXRA P19793 1/20 0.34
RXRB P28702 1/20 0.34
AHR P35869 1/20 0.34
MAOB P27338 1/20 0.33
CSNK2A2 P19784 1/20 0.33
CSNK2B P67870 1/20 0.33

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
SCHEMBL22456805 0.92 ALDH1A1 (0.41) ALDH1A1HPGDKDM4EKMT2ASMN1; SMN2
SCHEMBL22456454 0.90 ALDH1A1 (0.41) ALDH1A1HPGDKDM4EKMT2ASMN1; SMN2
SCHEMBL22456456 0.89 ALDH1A1 (0.46) ALDH1A1HPGDKDM4EKMT2ASMN1; SMN2
SCHEMBL19960014 0.89 ALDH1A1 (0.43) ALDH1A1HPGDKDM4EKMT2ASMN1; SMN2
SCHEMBL19960007 0.89 ALDH1A1 (0.43) ALDH1A1HPGDKDM4EKMT2ASMN1; SMN2
SCHEMBL22456496 0.89 ALDH1A1 (0.46) ALDH1A1HPGDKDM4EKMT2ASMN1; SMN2
SCHEMBL22456752 0.89 CHEK1 (0.41) ALDH1A1HPGDKDM4EKMT2ASMN1; SMN2
SCHEMBL19960010 0.88 ALDH1A1 (0.41) ALDH1A1HPGDKDM4EKMT2ASMN1; SMN2
SCHEMBL22456393 0.86 KDM4E (0.43) ALDH1A1HPGDKDM4EKMT2ASMN1; SMN2
SCHEMBL22457010 0.86 ALDH1A1 (0.43) ALDH1A1HPGDKDM4EKMT2ASMN1; SMN2

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 ALDH1A1 2038/4885HPGD 4184/4885KDM4E 2372/4885

“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.