SCHEMBL26518679

SCHEMBL26518679

c1ccc2c(c1)-c1ccccc1C2c1ccccc1-n1c2ccccc2c2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GPR3 P46089 3/20 0.38
▸ HTR2A P28223 1/20 0.35
▸ DUSP3 P51452 1/20 0.34
▸ CYP1A2 P05177 2/20 0.33
▸ POLB P06746 2/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ MEN1 O00255 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ KCNA3 P22001 1/20 0.31
▸ CYP2D6 P10635 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
SCHEMBL16446610 0.87 ALDH1A1 (0.37) ALDH1A1KDM4EATML3MBTL1GPR3
SCHEMBL21147973 0.81 ALDH1A1 (0.36) ALDH1A1KDM4EATML3MBTL1GPR3
SCHEMBL15447069 0.81 ALDH1A1 (0.36) ALDH1A1KDM4EATML3MBTL1GPR3
SCHEMBL22036906 0.78 KDM4E (0.35) ALDH1A1KDM4EATML3MBTL1GPR3
SCHEMBL25138530 0.78 IMPDH2 (0.36) ALDH1A1KDM4EATML3MBTL1MEN1
SCHEMBL25086168 0.78 IMPDH2 (0.36) ALDH1A1KDM4EATML3MBTL1MEN1
SCHEMBL17030716 0.78 KDM4E (0.44) ALDH1A1KDM4EATML3MBTL1POLB
SCHEMBL622966 0.78 ALDH1A1 (0.53) ALDH1A1KDM4EATML3MBTL1GPR3
SCHEMBL30198171 0.78 ALDH1A1 (0.53) ALDH1A1KDM4EATML3MBTL1GPR3
SCHEMBL19303748 0.77 IMPDH2 (0.36) ALDH1A1KDM4EATML3MBTL1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230329089-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-10-12 — — 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-20230329089-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES NR1H2, OXER1, NR1H3 ALDH1A1 669/4885KDM4E 2635/4885ATM 4242/4885

“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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