SCHEMBL22456897

SCHEMBL22456897

CP(C)(=O)c1ccc(-c2ccc3c4ccc5ncccc5c4c4nc5ccccc5n4c3c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.36
KDM4E B2RXH2 5/20 0.36
HPGD P15428 4/20 0.36
METAP2 P50579 1/20 0.35
KMT2A Q03164 5/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
MAPT P10636 5/20 0.34
POLB P06746 4/20 0.34
LMNA P02545 2/20 0.34
HSD17B10 Q99714 2/20 0.34
TP53 P04637 1/20 0.34
MAPK14 Q16539 1/20 0.33
ACVR1 Q04771 3/20 0.32
CAMKK1 Q8N5S9 2/20 0.32
CAMKK2 Q96RR4 2/20 0.32
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
CSNK2A1 P68400 1/20 0.32
PIM3 Q86V86 1/20 0.32
DYRK2 Q92630 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
SCHEMBL22456898 0.88 ALDH1A1 (0.38) ALDH1A1KDM4EHPGDKMT2ASMN1; SMN2
SCHEMBL22456496 0.85 ALDH1A1 (0.46) ALDH1A1KDM4EHPGDKMT2ASMN1; SMN2
SCHEMBL22456456 0.85 ALDH1A1 (0.46) ALDH1A1KDM4EHPGDKMT2ASMN1; SMN2
SCHEMBL22456952 0.85 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDKMT2ASMN1; SMN2
SCHEMBL22456899 0.81 ALDH1A1 (0.36) ALDH1A1KDM4EHPGDKMT2ASMN1; SMN2
SCHEMBL22456944 0.81 KDM4E (0.44) ALDH1A1KDM4EHPGDKMT2ASMN1; SMN2
SCHEMBL20427418 0.81 KDM4E (0.43) ALDH1A1KDM4EHPGDKMT2ASMN1; SMN2
SCHEMBL20090231 0.81 UTRN (0.35) ALDH1A1KDM4EHPGDMETAP2KMT2A
SCHEMBL22456454 0.80 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDKMT2ASMN1; SMN2
SCHEMBL14644211 0.79 ALDH1A1 (0.41) ALDH1A1KDM4EHPGDKMT2ASMN1; 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 2038/4885KDM4E 2372/4885HPGD 4184/4885

“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.