SCHEMBL18361015

SCHEMBL18361015

Cc1ccc2c(c1)c1cc(C)ccc1n2-c1ccc(C(F)(F)F)cc1-c1cc(C(F)(F)F)ccc1-n1c2ccccc2c2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 4/20 0.49
▸ PIK3CA P42336 1/20 0.38
▸ PIK3CB P42338 1/20 0.38
▸ PIK3CG P48736 1/20 0.38
▸ BCHE P06276 1/20 0.37
▸ ACHE P22303 1/20 0.37
▸ HSP90AA1 P07900 2/20 0.37
▸ PTGDR2 Q9Y5Y4 4/20 0.37
▸ PPARG P37231 1/20 0.36
▸ PPARA Q07869 1/20 0.36
▸ HRH1 P35367 1/20 0.36
▸ HTR6 P50406 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ TDO2 P48775 1/20 0.36
▸ IDO2 Q6ZQW0 1/20 0.36
▸ PDE2A O00408 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35
▸ PKM P14618 1/20 0.35

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
SCHEMBL26496751 0.96 KIF11 (0.50) KIF11PIK3CAPIK3CBPIK3CGHSP90AA1
SCHEMBL18374375 0.93 KIF11 (0.49) KIF11PIK3CAPIK3CBPIK3CGHSP90AA1
SCHEMBL19795556 0.91 KIF11 (0.47) KIF11PIK3CAPIK3CBPIK3CGHSP90AA1
SCHEMBL19795562 0.91 KIF11 (0.44) KIF11PIK3CAPIK3CBPIK3CGHSP90AA1
SCHEMBL18361132 0.90 KIF11 (0.54) KIF11HSP90AA1PPARGPPARAPDE2A
SCHEMBL23255677 0.89 KIF11 (0.40) KIF11PIK3CAPIK3CBPIK3CGACHE
SCHEMBL23255277 0.89 KIF11 (0.40) KIF11PIK3CAPIK3CBPIK3CGACHE
SCHEMBL23255483 0.88 KIF11 (0.39) KIF11PIK3CAPIK3CBPIK3CGPTGDR2
SCHEMBL21090393 0.88 KIF11 (0.39) KIF11PIK3CAPIK3CBPIK3CGTP53
SCHEMBL19795564 0.87 KIF11 (0.48) KIF11PIK3CAPIK3CBPIK3CGHSP90AA1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10263196-B2 Organic molecules for use in optoelectronic devices CYNORA GMBH (DE) 2019-04-16 — — US disclosed
EP-3138137-B1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2018-06-20 — — EP disclosed
US-20180026202-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-01-25 — — US disclosed
US-20180026202-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-01-25 — — US disclosed
WO-2017005699-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2017-01-12 — — WO disclosed
EP-3113239-A1 ORGANIC MOLECULES FOR USE IN ORGANIC OPTOELECTRONIC DEVICES cynora GmbH (DE) 2017-01-04 — — EP 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 (2 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-10263196-B2 Organic molecules for use in optoelectronic devices OR10J3, ORC3, OXER1 KIF11 4272/4885PIK3CA 4339/4885PIK3CB 4143/4885
US-20180026202-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES ORC3, OR10J3, C1R KIF11 4250/4885PIK3CA 4330/4885PIK3CB 4150/4885

“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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