SCHEMBL23947106

SCHEMBL23947106

COc1cc(Cl)cc(Br)c1-c1cccnc1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.42
CASP6 P55212 1/20 0.42
G6PD P11413 1/20 0.42
CYP1A1 P04798 1/20 0.40
CYP1B1 Q16678 1/20 0.40
MAP4K4 O95819 1/20 0.38
AKT1 P31749 1/20 0.37
FGFR2 P21802 1/20 0.37
FGFR3 P22607 1/20 0.37
GRM4 Q14833 1/20 0.37
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
MAPT P10636 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
FYN P06241 1/20 0.36
PLAU P00749 1/20 0.36

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
SCHEMBL23946599 0.81 PLAU (0.42) NSD2CASP6CYP1A1CYP1B1MAP4K4
SCHEMBL23946703 0.81 NSD2 (0.45) NSD2CASP6G6PDGRM4NPC1
SCHEMBL23946708 0.78 NSD2 (0.42) NSD2CASP6G6PDCYP1A1CYP1B1
SCHEMBL3664647 0.75 ALDH1A1 (0.50) G6PDCYP1A1CYP1B1NPC1MEN1
SCHEMBL23947286 0.75 NPC1 (0.35) NSD2CASP6G6PDCYP1A1CYP1B1
SCHEMBL23947579 0.75 CYP1A1 (0.40) CYP1A1CYP1B1L3MBTL1HSP90AA1HSP90AB1
SCHEMBL23947203 0.75 CYP1A2 (0.44) L3MBTL1HSP90AA1HSP90AB1
SCHEMBL23947502 0.72 HSP90AA1 (0.46) MAPTHSP90AA1HSP90AB1NR4A2
SCHEMBL23944311 0.72 PDGFRB (0.52) NSD2CASP6G6PDFGFR2FGFR3
SCHEMBL23944613 0.72 PDGFRB (0.52) NSD2CASP6G6PDFGFR2FGFR3

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 NSD2 453/4885CASP6 2167/4885G6PD 2671/4885

“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.