SCHEMBL21147323

SCHEMBL21147323

c1ccc(-c2cccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5ccc(-c6ccccc6)c(-n6c7ccccc7c7ccccc76)c5)n4)cc3-n3c4ccccc4c4cc(-c5ccccc5)ccc43)c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSPO P30536 1/20 0.36
KDM4E B2RXH2 2/20 0.35
ATM Q13315 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NPY5R Q15761 1/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.33
PDE7A Q13946 2/20 0.33
PDE7B Q9NP56 2/20 0.33
PTGER4 P35408 2/20 0.33
LMNA P02545 1/20 0.33
GLA P06280 1/20 0.33
ASH1L Q9NR48 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
SCHEMBL21147160 1.00 TSPO (0.36) TSPOKDM4EATML3MBTL1NPY5R
SCHEMBL21147171 1.00 TSPO (0.36) TSPOKDM4EATML3MBTL1NPY5R
SCHEMBL21147373 0.99 TSPO (0.37) TSPOKDM4EATML3MBTL1NPY5R
SCHEMBL24125346 0.99 TSPO (0.37) TSPOKDM4EATML3MBTL1NPY5R
SCHEMBL21147851 0.96 KDM4E (0.42) TSPOKDM4EATML3MBTL1NPY5R
SCHEMBL21146998 0.96 KDM4E (0.38) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL21147354 0.96 KDM4E (0.38) KDM4EATML3MBTL1MEN1KMT2A
SCHEMBL24125359 0.96 KDM4E (0.38) TSPOKDM4EATML3MBTL1NPY5R
SCHEMBL21147358 0.96 TSPO (0.38) TSPOKDM4EATML3MBTL1NPY5R
SCHEMBL21147000 0.96 KDM4E (0.38) KDM4EATML3MBTL1MEN1KMT2A

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-11706977-B2 Heterocyclic compound, composition including the same, and organic light-emitting device including the heterocyclic compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-07-18 US disclosed
US-11706977-B2 Heterocyclic compound, composition including the same, and organic light-emitting device including the heterocyclic compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2023-07-18 US disclosed
US-20190214570-A1 HETEROCYCLIC COMPOUND, COMPOSITION INCLUDING THE SAME, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE HETEROCYCLIC COMPOUND SAMSUNG ELECTRONICS CO., LTD. (KR) 2019-07-11 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-11706977-B2 Heterocyclic compound, composition including the same, and organic light-emitting device including the heterocyclic compound CRY1, CYP1B1, CYP1A1 TSPO 3072/4885KDM4E 2739/4885ATM 2932/4885
US-20190214570-A1 HETEROCYCLIC COMPOUND, COMPOSITION INCLUDING THE SAME, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE HETEROCYCLIC COMPOUND CRY1, CYP1B1, CYP1A1 TSPO 3072/4885KDM4E 2739/4885ATM 2932/4885

“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.