SCHEMBL21732802

SCHEMBL21732802

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(C4(c5ccccc5)c5ccccc5Sc5ccccc54)cc3)n2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
MEN1 O00255 6/20 0.38
KMT2A Q03164 6/20 0.38
MAPT P10636 3/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
LMNA P02545 4/20 0.36
KDM4E B2RXH2 2/20 0.36
OPRK1 P41145 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
ADORA2A P29274 4/20 0.35
ADORA1 P30542 4/20 0.35
ADORA3 P0DMS8 3/20 0.35
ADORA2B P29275 3/20 0.35
POLB P06746 1/20 0.35
NTSR1 P30989 1/20 0.34
ATM Q13315 1/20 0.33
GLA P06280 1/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33

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
SCHEMBL21732545 0.98 L3MBTL1 (0.38) L3MBTL1MEN1KMT2AMAPTALDH1A1
SCHEMBL23028813 0.92 L3MBTL1 (0.38) L3MBTL1MEN1KMT2AMAPTALDH1A1
SCHEMBL21743378 0.91 MEN1 (0.37) L3MBTL1MEN1KMT2AMAPTALDH1A1
SCHEMBL21743371 0.91 MEN1 (0.41) L3MBTL1MEN1KMT2AMAPTALDH1A1
SCHEMBL21743642 0.90 MEN1 (0.40) L3MBTL1MEN1KMT2AMAPTALDH1A1
SCHEMBL21743631 0.90 MEN1 (0.40) L3MBTL1MEN1KMT2AMAPTALDH1A1
SCHEMBL21743643 0.90 MEN1 (0.36) L3MBTL1MEN1KMT2AMAPTALDH1A1
SCHEMBL21743387 0.90 MEN1 (0.40) L3MBTL1MEN1KMT2AMAPTALDH1A1
SCHEMBL21743645 0.90 MEN1 (0.36) L3MBTL1MEN1KMT2AMAPTALDH1A1
SCHEMBL21743380 0.90 MEN1 (0.36) L3MBTL1MEN1KMT2AMAPTALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210053934-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2021-02-25 US disclosed
WO-2020036313-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2020-02-20 WO disclosed
WO-2020036314-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DIODE USING SAME 주식회사 엘지화학 2020-02-20 WO 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-20210053934-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME AOX1, CRY1, ALDH1A2 L3MBTL1 406/4885MEN1 782/4885KMT2A 1854/4885

“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.