SCHEMBL22477601

SCHEMBL22477601

Fc1ccccc1-c1cccc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.53
RAB9A P51151 5/20 0.53
KMT2A Q03164 4/20 0.53
L3MBTL1 Q9Y468 3/20 0.53
MEN1 O00255 3/20 0.53
PKM P14618 2/20 0.53
NFKB1 P19838 2/20 0.53
NFKB2 Q00653 2/20 0.53
RELA Q04206 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
MAPK1 P28482 1/20 0.53
MAOA P21397 1/20 0.48
BLVRB P30043 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
DPP4 P27487 1/20 0.48
BACE1 P56817 1/20 0.45
TRPA1 O75762 1/20 0.45
PTPRC P08575 1/20 0.43
PTPN1 P18031 1/20 0.43
KAT6A Q92794 1/20 0.43

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
SCHEMBL24417347 0.89 NPC1 (0.50) NPC1RAB9AKMT2AL3MBTL1MEN1
SCHEMBL24417306 0.88 MEN1 (0.49) NPC1RAB9AKMT2AL3MBTL1MEN1
SCHEMBL31367776 0.87 L3MBTL1 (0.45) NPC1RAB9AKMT2AL3MBTL1MEN1
SCHEMBL24450676 0.86 NPC1 (0.58) NPC1RAB9AKMT2AL3MBTL1MEN1
SCHEMBL19497487 0.86 L3MBTL1 (0.52) NPC1RAB9AKMT2AL3MBTL1MEN1
SCHEMBL20904976 0.86 KMT2A (0.50) NPC1RAB9AKMT2AL3MBTL1MEN1
SCHEMBL25826309 0.84 NPC1 (0.40) NPC1RAB9AKMT2AL3MBTL1MEN1
SCHEMBL24689429 0.84 L3MBTL1 (0.50) NPC1RAB9AKMT2AL3MBTL1MEN1
SCHEMBL21461840 0.84 KMT2A (0.59) NPC1RAB9AKMT2AL3MBTL1MEN1
SCHEMBL19762108 0.84 L3MBTL1 (0.50) NPC1RAB9AKMT2AL3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220162210-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME DUPONT SPECIALTY MATERIALS KOREA LTD (KR) 2022-05-26 US disclosed
WO-2020197240-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2020-10-01 WO 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-20220162210-A1 ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME OR10J3, CTCF, LAGE3 NPC1 2449/4885RAB9A 2198/4885KMT2A 1401/4885

“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.