SCHEMBL22158694

SCHEMBL22158694

Cc1cc(C)cc(-c2ccc3c(c2)c2ccccc2n3-c2cc(-c3cc(F)cc(F)c3)cc(-n3c4ccccc4c4cc(-c5cc(C)cc(C)c5)ccc43)c2C(F)(F)F)c1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 1/20 0.32
▸ NPY5R Q15761 3/20 0.31
▸ TSPO P30536 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ ATM Q13315 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL23299832 0.94 MAP4K4 (0.31) —
SCHEMBL22157889 0.93 AKR1C4 (0.33) KIF11NPY5RTSPOKDM4EATM
SCHEMBL22158681 0.93 KIF11 (0.35) KIF11KDM4EATML3MBTL1
SCHEMBL22157894 0.91 KIF11 (0.31) KIF11
SCHEMBL22156063 0.89 TSPO (0.37) KIF11NPY5RTSPOKDM4EATM
SCHEMBL22156035 0.89 BCHE (0.35) KIF11NPY5RKDM4EATML3MBTL1
SCHEMBL22158733 0.88 KIF11 (0.31) KIF11
SCHEMBL22157856 0.88 NR3C1 (0.39) —
SCHEMBL23299831 0.86 PTGS2 (0.31) —
SCHEMBL22157818 0.86 AR (0.35) —

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
EP-3635070-B1 ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2021-04-28 — — EP disclosed
US-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-06-25 — — 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-20200203628-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, OR51E2 KIF11 4485/4885NPY5R 1133/4885TSPO 499/4885

“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