SCHEMBL24617044

SCHEMBL24617044

CC(C)(C)c1ccc(-n2c3ccccc3c3cc(C#N)ccc32)cc1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.45
KDM4E B2RXH2 1/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PPARG P37231 4/20 0.41
RORC P51449 4/20 0.40
PPARA Q07869 2/20 0.39
PTGER4 P35408 2/20 0.39
USP14 P54578 3/20 0.38
CSNK1D P48730 1/20 0.38
CSNK1G2 P78368 1/20 0.38
SLC22A12 Q96S37 1/20 0.38
CCR9 P51686 1/20 0.38
EPHX2 P34913 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
SCHEMBL25708843 0.96 KIF11 (0.53) KIF11KDM4EATML3MBTL1PPARG
SCHEMBL24617064 0.93 KIF11 (0.44) KIF11KDM4EATML3MBTL1PPARG
SCHEMBL23624455 0.92 KIF11 (0.45) KIF11KDM4EATML3MBTL1PPARG
SCHEMBL22624275 0.90 KDM4E (0.52) KDM4EATML3MBTL1RORCPTGER4
SCHEMBL24127495 0.88 KDM4E (0.42) KIF11KDM4EATML3MBTL1PPARG
SCHEMBL17424694 0.88 RORC (0.40) KIF11KDM4EATML3MBTL1RORC
SCHEMBL26831723 0.88 RORC (0.40) KIF11KDM4EATML3MBTL1RORC
SCHEMBL17424670 0.88 RORC (0.40) KIF11KDM4EATML3MBTL1RORC
SCHEMBL17424684 0.88 RORC (0.40) KIF11KDM4EATML3MBTL1RORC
SCHEMBL20282454 0.88 KIF11 (0.41) KIF11KDM4EATML3MBTL1PPARG

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-20220220084-A1 ORGANIC COMPOUND, ELECTRONIC COMPONENT AND ELECTRONIC APPARATUS SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2022-07-14 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-20220220084-A1 ORGANIC COMPOUND, ELECTRONIC COMPONENT AND ELECTRONIC APPARATUS EXOC4, CYBA, SCO2 KIF11 3243/4885KDM4E 1635/4885ATM 2017/4885

“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.