SCHEMBL21532791

SCHEMBL21532791

c1ccc(-c2nnc(-c3ccccc3)n2-c2cccc3c4ccccc4n(-c4ccccc4-c4cccc(-n5c6ccccc6c6ccc7oc8ccccc8c7c65)c4)c23)cc1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.33
OPRD1 P41143 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
HIF1A Q16665 1/20 0.31
LMNA P02545 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
SCHEMBL21532566 0.94 OPRD1 (0.34) AKT1OPRD1KDM4EATML3MBTL1
SCHEMBL21532253 0.94 AKT1 (0.32) AKT1OPRD1
SCHEMBL21532789 0.94 ALDH1A1 (0.33) AKT1OPRD1KDM4EATML3MBTL1
SCHEMBL21532697 0.93 OPRD1 (0.34) AKT1OPRD1KDM4EATML3MBTL1
SCHEMBL21532788 0.93 ALDH1A1 (0.32) AKT1OPRD1KDM4EATML3MBTL1
SCHEMBL21532790 0.92 OPRD1 (0.32) OPRD1KDM4EATML3MBTL1SMN1; SMN2
SCHEMBL21532257 0.92 ALDH1A1 (0.32) OPRD1KDM4ESMN1; SMN2LMNA
SCHEMBL21532237 0.92 AKT1 (0.32) AKT1OPRD1
SCHEMBL21532780 0.91 AKT1 (0.38) AKT1KDM4ESMN1; SMN2HIF1A
SCHEMBL21532255 0.90 KDM4E (0.31) AKT1KDM4EATML3MBTL1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11145825-B2 Condensed cyclic compound and organic light-emitting device including i he same SAMSUNG ELECTRONICS CO., LTD. (KR) 2021-10-12 US disclosed
US-20190334095-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-10-31 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 (2 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-11145825-B2 Condensed cyclic compound and organic light-emitting device including i he same CRY1, CCNT1, CCNA1 AKT1 2105/4885OPRD1 417/4885KDM4E 4144/4885
US-20190334095-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CCNT1, ARL1 AKT1 2483/4885OPRD1 463/4885KDM4E 3893/4885

“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.