SCHEMBL22921101

SCHEMBL22921101

CC(C)(C)c1cccnc1-c1cc(-c2ccc3oc4ccccc4c3c2)cc(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.37
MAPT P10636 2/20 0.37
ALDH1A1 P00352 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
HSP90AA1 P07900 1/20 0.31
HSP90AB1 P08238 1/20 0.31
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
TRPV1 Q8NER1 1/20 0.30
CHEK2 O96017 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
SCHEMBL22921138 0.87 NPC1 (0.37) NPC1MAPTALDH1A1NPSR1HSP90AA1
SCHEMBL22921140 0.82 NPC1 (0.34) NPC1MAPTTRPV1
SCHEMBL804538 0.81 KDM4E (0.44) NPC1MAPTALDH1A1NPSR1RXFP1
SCHEMBL29360594 0.81 KDM4E (0.44) NPC1MAPTALDH1A1NPSR1RXFP1
SCHEMBL804733 0.81 KDM4E (0.44) NPC1MAPTALDH1A1NPSR1RXFP1
SCHEMBL804869 0.81 MAPT (0.42) NPC1MAPTALDH1A1HSP90AA1HSP90AB1
SCHEMBL804562 0.80 KDM4E (0.42) NPC1MAPTALDH1A1NPSR1RXFP1
SCHEMBL804543 0.80 KDM4E (0.42) NPC1MAPTALDH1A1NPSR1RXFP1
SCHEMBL11987370 0.79 KDM4E (0.41) NPC1MAPTALDH1A1NPSR1RXFP1
SCHEMBL804790 0.79 PLA2G2A (0.44) NPC1MAPTALDH1A1NPSR1RXFP1

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-11814374-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same LG DISPLAY CO., LTD. (KR) 2023-11-14 US disclosed
US-11814374-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same LG DISPLAY CO., LTD. (KR) 2023-11-14 US disclosed
US-20210024509-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME LG DISPLAY CO., LTD. (KR) 2021-01-28 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-11814374-B2 Organic compound, and organic light emitting diode and organic light emitting display device including the same OCIAD1, OCIAD2, AOX1 NPC1 526/4885MAPT 350/4885ALDH1A1 89/4885
US-20210024509-A1 ORGANIC COMPOUND, AND ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DISPLAY DEVICE INCLUDING THE SAME OCIAD1, OCIAD2, AOX1 NPC1 526/4885MAPT 350/4885ALDH1A1 89/4885

“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.