SCHEMBL21861129

SCHEMBL21861129

c1ccc(-c2nc(-c3ccccc3)nc(-c3ccc(-c4cc5ccccc5c5c4sc4ccccc45)cc3)n2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 5/20 0.36
▸ KMT2A Q03164 5/20 0.36
▸ MAPT P10636 4/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ HPGD P15428 3/20 0.36
▸ KDM4E B2RXH2 3/20 0.36
▸ MPI P34949 1/20 0.36
▸ TNKS O95271 2/20 0.36
▸ TNKS2 Q9H2K2 2/20 0.36
▸ ALOX5 P09917 1/20 0.36
▸ ATM Q13315 1/20 0.35
▸ GPR84 Q9NQS5 2/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ LIMK1 P53667 2/20 0.34
▸ CYP11B1 P15538 1/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ ADORA1 P30542 1/20 0.34
▸ NQO1 P15559 1/20 0.34
▸ NQO2 P16083 1/20 0.34
▸ ABCG2 Q9UNQ0 1/20 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
SCHEMBL19197073 0.91 MEN1 (0.42) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL22894201 0.87 EGLN1 (0.34) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL23681938 0.86 — —
SCHEMBL22688420 0.85 PRKDC (0.36) MAPTALDH1A1HPGDKDM4EALOX5
SCHEMBL27361607 0.85 LIMK1 (0.36) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL24223102 0.84 MAPT (0.39) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL26472873 0.84 ALOX5 (0.39) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL31625419 0.84 PTGES (0.37) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL25023003 0.84 LIMK1 (0.39) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL14882844 0.84 TNKS (0.37) MEN1KMT2AMAPTALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11362282-B2 Heterocyclic compound and organic light emitting element comprising same LT MATERIALS CO., LTD. (KR) 2022-06-14 — — US disclosed
US-20210234102-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LT MATERIALS CO., LTD. (KR) 2021-07-29 — — US disclosed
US-20210226133-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME LT Materials Co., Ltd (KR) 2021-07-22 — — US disclosed
WO-2020067593-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME 희성소재(주) 2020-04-02 — — 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 (3 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-20210234102-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, CYP1A1 MEN1 351/4885KMT2A 592/4885MAPT 1487/4885
US-20210226133-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT COMPRISING SAME CRY1, CRY2, CYP1A1 MEN1 351/4885KMT2A 592/4885MAPT 1487/4885
US-11362282-B2 Heterocyclic compound and organic light emitting element comprising same CRY1, CRY2, CYP1A1 MEN1 351/4885KMT2A 592/4885MAPT 1487/4885

“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.

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