SCHEMBL22456473

SCHEMBL22456473

CP(C)(=O)c1ccc2ccc(-c3ccc4c5cc(-c6ccccc6)ccc5n5c6ccc(-c7ccccc7)cc6nc5c4c3)cc2c1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
HDAC1 Q13547 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
NR4A2 P43354 1/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
HSD17B10 Q99714 1/20 0.31
DHFR P00374 1/20 0.31
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
LDHA P00338 1/20 0.30

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
SCHEMBL22456748 0.87 KDM4E (0.40) KDM4EALDH1A1HPGDLMNATP53
SCHEMBL22456742 0.85 TUBB4A (0.36) KDM4EALDH1A1HPGDLMNATP53
SCHEMBL22456447 0.82 ALDH1A1 (0.42) KDM4EALDH1A1HPGDLMNATP53
SCHEMBL22456472 0.81 KDM4E (0.36) KDM4EALDH1A1HPGDESR1ESR2
SCHEMBL19928972 0.81 KDM4E (0.41) KDM4EALDH1A1HPGDLMNATP53
SCHEMBL15479271 0.81 ALDH1A1 (0.39) KDM4EALDH1A1HPGDLMNATP53
SCHEMBL18118561 0.80 KDM4E (0.41) KDM4EALDH1A1HPGDLMNATP53
SCHEMBL15479270 0.79 KDM4E (0.43) KDM4EALDH1A1HPGDLMNATP53
SCHEMBL10023477 0.79 KDM4E (0.48) KDM4EALDH1A1HPGDESR1ESR2
SCHEMBL22457010 0.78 ALDH1A1 (0.43) KDM4EALDH1A1HPGDLMNATP53

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 KDM4E 2372/4885ALDH1A1 2038/4885HPGD 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.