SCHEMBL23917435

SCHEMBL23917435

c1ccc(Nc2cc(N3CCCc4ccccc43)cc(N3CCCc4c3cccc4N3CCCc4ccccc43)c2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 1/20 0.40
EED O75530 1/20 0.39
NUDT1 P36639 1/20 0.39
MEN1 O00255 1/20 0.37
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.37
OPRM1 P35372 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
JAK2 O60674 1/20 0.37
JAK3 P52333 1/20 0.37
PTK2 Q05397 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPK1 P28482 1/20 0.37
AKT1 P31749 1/20 0.36
PIK3CA P42336 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
SCHEMBL22975005 0.92 NUDT1 (0.43) ROCK1EEDNUDT1MEN1LMNA
SCHEMBL23908719 0.82 ROCK1 (0.43) ROCK1NUDT1MEN1KMT2AOPRM1
SCHEMBL23917430 0.82 MAPT (0.43) ROCK1EEDMEN1KMT2AJAK2
SCHEMBL23908721 0.81 EED (0.38) ROCK1EEDNUDT1MEN1LMNA
SCHEMBL23917574 0.78 ROCK1 (0.38) ROCK1EEDNUDT1MEN1LMNA
SCHEMBL693233 0.73 ROCK1 (0.51) ROCK1NUDT1MEN1LMNAKMT2A
SCHEMBL29478502 0.73 ROCK1 (0.51) ROCK1NUDT1MEN1LMNAKMT2A
SCHEMBL23917431 0.72 TSHR (0.35) ROCK1NUDT1MEN1LMNAKMT2A
SCHEMBL23917713 0.72 SPR (0.49) ROCK1EEDNUDT1MEN1KMT2A
SCHEMBL24043567 0.71 ROCK1 (0.37) ROCK1EEDNUDT1MEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210320254-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2021-10-14 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 (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-20210320254-A1 CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME ORAI2, SLC39A11, SLC39A7 ROCK1 4061/4885EED 549/4885NUDT1 2665/4885

“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.