SCHEMBL21147232

SCHEMBL21147232

c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccccc5)ccc43)c(-c3ccc(-c4ccc(-c5nc(-c6ccccc6)nc(-c6ccc(-c7ccccc7)c(-n7c8ccccc8c8ccccc87)c6)n5)cc4)cc3)c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSPO P30536 1/20 0.36
ATM Q13315 2/20 0.34
KDM4E B2RXH2 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ACP1 P24666 2/20 0.34
NPY5R Q15761 2/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HPGD P15428 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.33
PTGER4 P35408 3/20 0.32
DNM1 Q05193 1/20 0.31
STAT6 P42226 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PIK3CA P42336 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
SCHEMBL21147325 1.00 TSPO (0.36) TSPOATMKDM4EL3MBTL1ACP1
SCHEMBL21147231 1.00 TSPO (0.36) TSPOATMKDM4EL3MBTL1ACP1
SCHEMBL21147047 0.96 TSPO (0.34) TSPOATMKDM4EL3MBTL1ACP1
SCHEMBL21147046 0.96 TSPO (0.34) TSPOATMKDM4EL3MBTL1ACP1
SCHEMBL21147852 0.96 L3MBTL1 (0.37) ATMKDM4EL3MBTL1ACP1MEN1
SCHEMBL21147358 0.95 TSPO (0.38) TSPOATMKDM4EL3MBTL1ACP1
SCHEMBL21147229 0.95 TSPO (0.38) TSPOATMKDM4EL3MBTL1ACP1
SCHEMBL21147345 0.95 KDM4E (0.38) ATMKDM4EL3MBTL1ACP1MEN1
SCHEMBL21147529 0.94 L3MBTL1 (0.35) ATMKDM4EL3MBTL1ACP1MEN1
SCHEMBL21147318 0.94 KDM4E (0.35) ATMKDM4EL3MBTL1ACP1MEN1

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 3072/4885ATM 2932/4885KDM4E 2739/4885
US-20190214570-A1 HETEROCYCLIC COMPOUND, COMPOSITION INCLUDING THE SAME, AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE HETEROCYCLIC COMPOUND CRY1, CYP1B1, CYP1A1 TSPO 3072/4885ATM 2932/4885KDM4E 2739/4885

“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.