SCHEMBL22156445

SCHEMBL22156445

CC(C)(C)c1ccc2c(c1)c1ccccc1n2-c1cc(C#N)cc(-n2c3ccccc3c3cc(C(C)(C)C)ccc32)c1-c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 9/20 0.36
▸ PGR P06401 1/20 0.33
▸ RORA P35398 1/20 0.33
▸ RORB Q92753 1/20 0.33
▸ KIF11 P52732 4/20 0.33
▸ AR P10275 2/20 0.32
▸ PTGER4 P35408 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ CASP1 P29466 1/20 0.31
▸ HSD17B10 Q99714 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
SCHEMBL22156443 0.94 KIF11 (0.36) RORCKIF11PTGER4
SCHEMBL22156681 0.94 KIF11 (0.36) KIF11
SCHEMBL22156840 0.90 RORC (0.35) RORCPGRRORARORBKIF11
SCHEMBL22156444 0.88 KIF11 (0.36) KIF11
SCHEMBL22155887 0.86 RORC (0.35) RORCPGRRORARORBKIF11
SCHEMBL22158371 0.86 PDE9A (0.34) RORCPGRRORARORBPTGER4
SCHEMBL21414232 0.86 KIF11 (0.37) RORCPGRRORARORBKIF11
SCHEMBL22156680 0.85 KDM4E (0.36) RORCPTGER4KDM4EALDH1A1MAPT
SCHEMBL22156690 0.85 KDM4E (0.36) RORCPTGER4KDM4EALDH1A1MAPT
SCHEMBL26776857 0.84 RORC (0.36) RORCKIF11PTGER4MAPT

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-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 RORC 869/4885PGR 2348/4885RORA 798/4885

“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.

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