SCHEMBL21532622

SCHEMBL21532622

c1ccc(-c2nnc(-c3cccc4c3c3ccccc3n4-c3ccccc3-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5ccccc5)c34)n2-c2ccccc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 3/20 0.38
KDM4E B2RXH2 3/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
AVPR1A P37288 1/20 0.36
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 2/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.34
HPGD P15428 1/20 0.34
HSD11B1 P28845 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
HIF1A Q16665 1/20 0.32
DUSP3 P51452 1/20 0.32
HDAC6 Q9UBN7 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
SCHEMBL21532795 0.97 AKT1 (0.37) AKT1KDM4EATML3MBTL1AVPR1A
SCHEMBL21532451 0.97 AKT1 (0.38) AKT1KDM4EATML3MBTL1AVPR1A
SCHEMBL21532517 0.94 AKT1 (0.38) AKT1KDM4EATML3MBTL1AVPR1A
SCHEMBL21532262 0.93 KDM4E (0.35) AKT1KDM4EATML3MBTL1AVPR1A
SCHEMBL21532727 0.91 KDM4E (0.39) AKT1KDM4EATML3MBTL1AVPR1A
SCHEMBL21532805 0.90 KDM4E (0.38) AKT1KDM4EATML3MBTL1AVPR1A
SCHEMBL21532445 0.90 KDM4E (0.39) AKT1KDM4EATML3MBTL1AVPR1A
SCHEMBL21532415 0.90 KDM4E (0.39) AKT1KDM4EATML3MBTL1AVPR1A
SCHEMBL21532797 0.89 AKT1 (0.38) AKT1KDM4EATML3MBTL1AVPR1A
SCHEMBL21532461 0.89 AVPR1A (0.40) KDM4EATML3MBTL1AVPR1AALDH1A1

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 2105/4885KDM4E 4144/4885ATM 622/4885
US-20190334095-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CCNT1, ARL1 AKT1 2483/4885KDM4E 3893/4885ATM 368/4885

“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.