SCHEMBL23348381

SCHEMBL23348381

CC(C)(C)c1ccc2c(c1)c1ccc(C(C)(C)C)cc1n2-c1cc(F)cc(-n2c3ccc(C(C)(C)C)cc3c3ccc(C(C)(C)C)cc32)c1-c1ccc(C#N)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.43
KDM1A O60341 5/20 0.38
RORC P51449 1/20 0.33
PGR P06401 2/20 0.32
CYP19A1 P11511 1/20 0.32
CSNK1D P48730 3/20 0.31
CSNK1G2 P78368 2/20 0.31
CSNK1A1 P48729 1/20 0.31
MAPK14 Q16539 1/20 0.31
KCNH2 Q12809 1/20 0.31
ESR1 P03372 1/20 0.31
RAPGEF3 O95398 1/20 0.30
RAPGEF4 Q8WZA2 1/20 0.30
PTPN5 P54829 1/20 0.30
CHEK1 O14757 1/20 0.30

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
SCHEMBL23348397 0.92 KIF11 (0.41) KIF11KDM1ARORCPGRPTPN5
SCHEMBL23348383 0.91 KIF11 (0.38) KIF11KDM1APGRCSNK1DCSNK1A1
SCHEMBL23348327 0.89 KIF11 (0.35) KIF11KDM1AKCNH2RAPGEF3RAPGEF4
SCHEMBL23348414 0.88 KIF11 (0.46) KIF11KDM1ARORCPGRCYP19A1
SCHEMBL23348544 0.85 KIF11 (0.48) KIF11KDM1ARORCPGRCYP19A1
SCHEMBL22156860 0.85 KIF11 (0.37) KIF11PGRCSNK1DCSNK1G2KCNH2
SCHEMBL23348411 0.84 KIF11 (0.36) KIF11KDM1ARORCPGR
SCHEMBL22156861 0.83 KIF11 (0.38) KIF11KDM1APGRCSNK1DCSNK1G2
SCHEMBL23348403 0.83 KCNH2 (0.35) KIF11PGRKCNH2RAPGEF3RAPGEF4
SCHEMBL23348463 0.83 KIF11 (0.36) KIF11KDM1APGRCSNK1DCSNK1A1

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-20210139425-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME SAMSUNG DISPLAY CO., LTD. (KR) 2021-05-13 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-20210139425-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CCND2, CCND1, CRY1 KIF11 1724/4885KDM1A 1915/4885RORC 1165/4885

“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.