SCHEMBL23348404

SCHEMBL23348404

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.39
CSNK1D P48730 5/20 0.34
CSNK1G2 P78368 4/20 0.34
RORC P51449 2/20 0.34
HTR1D P28221 1/20 0.33
CSNK1A1 P48729 1/20 0.32
GSK3B P49841 1/20 0.32
CYP19A1 P11511 1/20 0.32
CCR9 P51686 1/20 0.32
KCNH2 Q12809 1/20 0.31
GRM2 Q14416 1/20 0.31
PGR P06401 1/20 0.31
RORA P35398 1/20 0.31
RORB Q92753 1/20 0.31
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
S1PR4 O95977 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HSP90AA1 P07900 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL13912245 0.94 KIF11 (0.43) KIF11CSNK1DCSNK1G2RORCHTR1D
SCHEMBL13132836 0.92 KIF11 (0.38) KIF11RORCGRM2PGRRORA
SCHEMBL21758011 0.91 KIF11 (0.43) KIF11CSNK1DCSNK1G2RORCHTR1D
SCHEMBL13232638 0.90 RORC (0.40) KIF11CSNK1DCSNK1G2RORCPGR
SCHEMBL22319456 0.90 RORC (0.40) KIF11CSNK1DCSNK1G2RORCPGR
SCHEMBL23348379 0.88 KIF11 (0.51) KIF11CSNK1DCSNK1G2RORCCSNK1A1
SCHEMBL23348321 0.88 KIF11 (0.41) KIF11RORCGRM2PGRALDH1A1
SCHEMBL23348283 0.87 KIF11 (0.35) KIF11CSNK1DCSNK1G2HTR1DKCNH2
SCHEMBL17934994 0.84 PGR (0.38) KIF11RORCGRM2PGRRORA
SCHEMBL23348299 0.83 HTR1D (0.32) KIF11HTR1DKCNH2PGR

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 1724/4885CSNK1D 1514/4885CSNK1G2 2916/4885

“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.