SCHEMBL19795565

SCHEMBL19795565

Cc1ccc(-n2c3ccc(-c4ccccc4C)cc3c3cc(-c4ccccc4C)ccc32)c(-c2cc(C(F)(F)F)ccc2-n2c3ccc(-c4ccccc4C)cc3c3cc(-c4ccccc4C)ccc32)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 1/20 0.39
▸ ERBB2 P04626 1/20 0.37
▸ PDK2 Q15119 1/20 0.36
▸ BACE1 P56817 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ KIF11 P52732 3/20 0.35
▸ NR3C1 P04150 1/20 0.35
▸ PGR P06401 1/20 0.35
▸ PIK3CA P42336 1/20 0.34
▸ PIK3CB P42338 1/20 0.34
▸ PIK3CG P48736 1/20 0.34
▸ CETP P11597 1/20 0.33
▸ CYP3A4 P08684 4/20 0.33
▸ CYP1A2 P05177 3/20 0.33
▸ CYP2C19 P33261 3/20 0.33
▸ CYP2D6 P10635 2/20 0.33
▸ TSHR P16473 2/20 0.33
▸ CLK4 Q9HAZ1 2/20 0.33
▸ CYP2C9 P11712 2/20 0.33
▸ ICMT O60725 2/20 0.33

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
SCHEMBL18374378 0.95 AR (0.42) ARERBB2PDK2BACE1KIF11
SCHEMBL19795555 0.88 KIF11 (0.41) BACE1HSP90AA1KIF11PIK3CAPIK3CB
SCHEMBL19795557 0.87 KIF11 (0.41) BACE1HSP90AA1KIF11PIK3CAPIK3CB
SCHEMBL18374152 0.85 KIF11 (0.41) BACE1KIF11PIK3CAPIK3CBPIK3CG
SCHEMBL21089871 0.85 LMNA (0.38) ARERBB2BACE1NR3C1PGR
SCHEMBL19795556 0.85 KIF11 (0.47) HSP90AA1KIF11PIK3CAPIK3CBPIK3CG
SCHEMBL26496751 0.83 KIF11 (0.50) HSP90AA1KIF11PIK3CAPIK3CBPIK3CG
SCHEMBL18374375 0.83 KIF11 (0.49) HSP90AA1KIF11PIK3CAPIK3CBPIK3CG
SCHEMBL23255307 0.83 PDE10A (0.39) ARERBB2KIF11NR3C1PGR
SCHEMBL21399782 0.83 AR (0.43) ARERBB2PDK2BACE1KIF11

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 AR 1309/4885ERBB2 1545/4885PDK2 4344/4885

“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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