SCHEMBL21452025

SCHEMBL21452025

c1ccc(-c2ccc(N(c3ccccc3)c3ccc4cc5c6ccc(N(c7ccccc7)c7ccc(-c8ccccc8)cc7)cc6n(-c6ccccc6)c5cc4c3)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ ATM Q13315 1/20 0.37
▸ ALDH1A1 P00352 3/20 0.33
▸ MAPT P10636 2/20 0.33
▸ GFER P55789 1/20 0.33
▸ MAT2A P31153 4/20 0.31
▸ PRMT5 O14744 2/20 0.31
▸ CYP1A2 P05177 2/20 0.31
▸ AVPR1A P37288 1/20 0.31
▸ FGFR1 P11362 1/20 0.31
▸ TSPO P30536 1/20 0.30
▸ ESR1 P03372 1/20 0.30
▸ ESR2 Q92731 1/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2D6 P10635 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ CYP2C19 P33261 1/20 0.30
▸ TDP1 Q9NUW8 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
SCHEMBL21452038 0.99 KDM4E (0.38) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL24032286 0.95 KDM4E (0.45) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL23029181 0.95 KDM4E (0.41) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL21450381 0.94 KDM4E (0.46) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL29297680 0.94 KDM4E (0.46) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL21450383 0.94 KDM4E (0.46) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL21450432 0.93 KDM4E (0.40) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL23029120 0.92 FGFR1 (0.35) KDM4EL3MBTL1ATMFGFR1ESR1
SCHEMBL21968599 0.92 KDM4E (0.37) KDM4EL3MBTL1ATMALDH1A1MAPT
SCHEMBL21452036 0.92 KDM4E (0.39) KDM4EL3MBTL1ATMALDH1A1MAPT

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-20210057650-A1 AMINE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG CHEM, LTD. (KR) 2021-02-25 — — US disclosed
WO-2019194617-A1 AMINE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME 주식회사 엘지화학 2019-10-10 — — 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-20210057650-A1 AMINE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME DRD1, RNF10, DRD2 KDM4E 2073/4885L3MBTL1 35/4885ATM 943/4885

“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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