SCHEMBL19795557

SCHEMBL19795557

Cc1ccc(-n2c3ccc(C)cc3c3cc(-c4ccccc4)ccc32)c(-c2cc(C(F)(F)F)ccc2-n2c3ccc(C)cc3c3cc(-c4ccccc4)ccc32)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 4/20 0.41
▸ DHODH Q02127 1/20 0.39
▸ PIK3CA P42336 1/20 0.37
▸ PIK3CB P42338 1/20 0.37
▸ PIK3CG P48736 1/20 0.37
▸ ICMT O60725 2/20 0.37
▸ PTGDR2 Q9Y5Y4 4/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ TP53 P04637 1/20 0.35
▸ PTPN5 P54829 1/20 0.35
▸ TDO2 P48775 1/20 0.35
▸ IDO2 Q6ZQW0 1/20 0.35
▸ MAT2A P31153 1/20 0.34
▸ BACE1 P56817 1/20 0.34
▸ GLO1 Q04760 1/20 0.34

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
SCHEMBL19795555 0.99 KIF11 (0.41) KIF11DHODHPIK3CAPIK3CBPIK3CG
SCHEMBL18374152 0.99 KIF11 (0.41) KIF11DHODHPIK3CAPIK3CBPIK3CG
SCHEMBL18374182 0.91 KIF11 (0.49) KIF11DHODHPTGDR2HSP90AA1BACE1
SCHEMBL20997102 0.90 DHODH (0.39) KIF11DHODHPIK3CAPIK3CBPIK3CG
SCHEMBL19795556 0.88 KIF11 (0.47) KIF11PIK3CAPIK3CBPIK3CGPTGDR2
SCHEMBL18374375 0.87 KIF11 (0.49) KIF11PIK3CAPIK3CBPIK3CGPTGDR2
SCHEMBL19795565 0.87 AR (0.39) KIF11PIK3CAPIK3CBPIK3CGICMT
SCHEMBL20364454 0.86 KIF11 (0.46) KIF11DHODHICMTMAT2ABACE1
SCHEMBL18361015 0.86 KIF11 (0.49) KIF11PIK3CAPIK3CBPIK3CGPTGDR2
SCHEMBL26496877 0.85 DHODH (0.37) KIF11DHODHPIK3CAPIK3CBPIK3CG

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-20180026202-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-01-25 — — 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-20180026202-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES ORC3, OR10J3, C1R KIF11 4250/4885DHODH 4354/4885PIK3CA 4330/4885

“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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