SCHEMBL21532545

SCHEMBL21532545

c1ccc(-c2nnc(-c3ccccc3)n2-c2cccc3c2c2ccccc2n3-c2ccccc2-c2ccccc2-n2c3ccccc3c3ccc4oc5ccccc5c4c32)cc1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.33
HIF1A Q16665 1/20 0.33
HSD11B1 P28845 1/20 0.32
DUSP3 P51452 1/20 0.31

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
SCHEMBL21532318 0.95 SMN1; SMN2 (0.34) AKT1SMN1; SMN2HIF1A
SCHEMBL21532780 0.93 AKT1 (0.38) AKT1SMN1; SMN2HIF1AHSD11B1DUSP3
SCHEMBL21532253 0.92 AKT1 (0.32) AKT1
SCHEMBL21532543 0.90 KDM4E (0.34) AKT1SMN1; SMN2
SCHEMBL21532482 0.90 AKT1 (0.36) AKT1SMN1; SMN2HIF1AHSD11B1DUSP3
SCHEMBL21532549 0.89 AKT1 (0.35) AKT1SMN1; SMN2HIF1AHSD11B1DUSP3
SCHEMBL21532714 0.88 OPRD1 (0.33) AKT1SMN1; SMN2HIF1A
SCHEMBL21532786 0.88 KDM4E (0.36) AKT1SMN1; SMN2HSD11B1
SCHEMBL21532621 0.87 KDM4E (0.34) AKT1SMN1; SMN2HSD11B1
SCHEMBL21532778 0.87 ALDH1A1 (0.35) AKT1SMN1; 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 2105/4885SMN1; SMN2 2430/4885HIF1A 657/4885
US-20190334095-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME CRY1, CCNT1, ARL1 AKT1 2483/4885SMN1; SMN2 2103/4885HIF1A 1000/4885

“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.