SCHEMBL23947250

SCHEMBL23947250

COc1ccccc1-c1c(Br)cnc(Cl)c1N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.43
HSP90AA1 P07900 2/20 0.43
HSP90AB1 P08238 1/20 0.43
ALDH1A1 P00352 7/20 0.42
KDM4E B2RXH2 4/20 0.42
HPGD P15428 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SCN9A Q15858 1/20 0.39
APP P05067 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
HSD17B10 Q99714 3/20 0.38
GAA P10253 1/20 0.38
METAP2 P50579 1/20 0.37
PLG P00747 1/20 0.37
PLAU P00749 1/20 0.37
PLAT P00750 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
TDP1 Q9NUW8 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
SCHEMBL23944528 0.84 TLR8 (0.38) KMT2AHSP90AA1HSP90AB1ALDH1A1KDM4E
SCHEMBL25622550 0.82 ALDH1A1 (0.41) KMT2AALDH1A1KDM4EHPGDL3MBTL1
SCHEMBL23946628 0.77 KMT2A (0.43) KMT2AHSP90AA1HSP90AB1ALDH1A1KDM4E
SCHEMBL23946769 0.75 ALDH1A1 (0.45) KMT2AHSP90AA1HSP90AB1ALDH1A1KDM4E
SCHEMBL2541138 0.73 HSP90AA1 (0.47) HSP90AA1HSP90AB1ALDH1A1KDM4EADORA2A
SCHEMBL22479140 0.72 HSP90AA1 (0.46) KMT2AHSP90AA1HSP90AB1ALDH1A1KDM4E
SCHEMBL23947574 0.72 ALDH1A1 (0.45) HSP90AA1HSP90AB1ALDH1A1KDM4EHPGD
SCHEMBL23946975 0.71 HSP90AA1 (0.56) KMT2AHSP90AA1HSP90AB1ALDH1A1KDM4E
SCHEMBL27527937 0.71 PLG (0.53) KMT2AALDH1A1KDM4EHPGDL3MBTL1
SCHEMBL23947124 0.70 HSP90AA1 (0.40) HSP90AA1HSP90AB1ALDH1A1KDM4EL3MBTL1

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-20230174544-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2023-06-08 US disclosed
WO-2021210911-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2021-10-21 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-20230174544-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME CRY2, CYBA, AHR KMT2A 2984/4885HSP90AA1 4526/4885HSP90AB1 4323/4885

“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.