SCHEMBL23944935

SCHEMBL23944935

Clc1cc(-c2nc(-c3ccccc3)nc(-c3ccccc3)n2)c2c(c1)oc1cc3cnccc3cc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HASPIN Q8TF76 5/20 0.42
▸ CLK1 P49759 1/20 0.38
▸ IKBKB O14920 3/20 0.37
▸ ALOX5 P09917 1/20 0.36
▸ IMPDH2 P12268 1/20 0.35
▸ AHR P35869 1/20 0.34
▸ TNF P01375 1/20 0.34
▸ PIM1 P11309 3/20 0.33
▸ TGFBR1 P36897 1/20 0.33
▸ MAPK10 P53779 1/20 0.33
▸ CHUK O15111 1/20 0.32
▸ LCK P06239 1/20 0.32
▸ ROCK1 Q13464 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ MAPT P10636 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ NPC1 O15118 2/20 0.32

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
SCHEMBL23944667 1.00 HASPIN (0.42) HASPINCLK1IKBKBALOX5IMPDH2
SCHEMBL23449832 0.90 AHR (0.39) AHRMAPK1MAPTMEN1KMT2A
SCHEMBL23943979 0.89 HASPIN (0.43) HASPINCLK1IKBKBALOX5IMPDH2
SCHEMBL24762859 0.89 HASPIN (0.43) HASPINCLK1IKBKBALOX5IMPDH2
SCHEMBL23944551 0.88 HASPIN (0.43) HASPINCLK1IKBKBALOX5IMPDH2
SCHEMBL24762303 0.88 HASPIN (0.43) HASPINCLK1IKBKBALOX5IMPDH2
SCHEMBL24762302 0.88 HASPIN (0.43) HASPINCLK1IKBKBALOX5IMPDH2
SCHEMBL23944550 0.88 HASPIN (0.43) HASPINCLK1IKBKBALOX5IMPDH2
SCHEMBL24762290 0.86 HASPIN (0.45) HASPINCLK1IKBKBALOX5IMPDH2
SCHEMBL23944352 0.86 HASPIN (0.45) HASPINCLK1IKBKBALOX5IMPDH2

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-20220402928-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME LG CHEM, LTD. (KR) 2022-12-22 — — US disclosed
WO-2021210910-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING 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-20220402928-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING THE SAME CCNL2, CRY1, CRY2 HASPIN 4710/4885CLK1 458/4885IKBKB 3321/4885

“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.

Send feedback