SCHEMBL21168852

SCHEMBL21168852

c1ccc(-c2nc3ccccc3nc2-c2ccc(-n3c4ccccc4c4cc5c6cc7ccccc7cc6n(-c6ccccc6)c5cc43)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.45
KDM4E B2RXH2 3/20 0.45
ATM Q13315 1/20 0.45
LMNA P02545 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
ALDH1A1 P00352 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
GAA P10253 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
DHODH Q02127 1/20 0.39
ESR1 P03372 3/20 0.38
ESR2 Q92731 3/20 0.38
TSHR P16473 1/20 0.37
PDE10A Q9Y233 1/20 0.37
THRB P10828 1/20 0.37
MGAM O43451 1/20 0.37
SI P14410 1/20 0.37
MGAM2 Q2M2H8 1/20 0.37
NPY5R Q15761 1/20 0.37

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
SCHEMBL21168917 1.00 L3MBTL1 (0.45) L3MBTL1KDM4EATMLMNATDP1
SCHEMBL19507465 0.96 L3MBTL1 (0.45) L3MBTL1KDM4EATMLMNATDP1
SCHEMBL17759776 0.95 L3MBTL1 (0.50) L3MBTL1KDM4EATMLMNATDP1
SCHEMBL21168919 0.94 L3MBTL1 (0.40) L3MBTL1KDM4EATMLMNATDP1
SCHEMBL21168851 0.94 L3MBTL1 (0.40) L3MBTL1KDM4EATMLMNATDP1
SCHEMBL21168854 0.94 L3MBTL1 (0.39) L3MBTL1KDM4EATMLMNATDP1
SCHEMBL22141623 0.93 KDM4E (0.43) L3MBTL1KDM4EATMLMNATDP1
SCHEMBL21716216 0.93 L3MBTL1 (0.41) L3MBTL1KDM4EATMLMNATDP1
SCHEMBL21716715 0.93 L3MBTL1 (0.41) L3MBTL1KDM4EATMLMNATDP1
SCHEMBL21168855 0.91 ALDH1A1 (0.40) L3MBTL1KDM4ELMNATDP1ALDH1A1

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-20210328152-A1 ORGANIC ELECTROLUMINESCENT DEVICE ROHM & HAAS ELECT MATERIALS KOREA LTD (KR) 2021-10-21 US disclosed
US-20200058882-A1 ORGANIC ELECTROLUMINESCENT DEVICE ROHM & HAAS ELECT MATERIALS KOREA LTD (KR) 2020-02-20 US disclosed
US-20190355912-A1 ORGANIC ELECTROLUMINESCENT DEVICE ROHM & HAAS ELECT MATERIALS KOREA LTD (KR) 2019-11-21 US disclosed
US-20190221752-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2019-07-18 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 (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-20190221752-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME EPCAM, OR10J3, L1CAM L3MBTL1 960/4885KDM4E 763/4885ATM 1583/4885

“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.