SCHEMBL12320516

SCHEMBL12320516

Cn1ccc2cc3c(ccc4c5cc6cc(C(F)(F)F)n(C)c6cc5ccc34)cc21

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CYP2A6 P11509 2/20 0.35
▸ PRKCI P41743 1/20 0.34
▸ PIK3CB P42338 1/20 0.32
▸ CCNE2 O96020 1/20 0.31
▸ CDK4 P11802 1/20 0.31
▸ CCND1 P24385 1/20 0.31
▸ CCNE1 P24864 1/20 0.31
▸ CDK2 P24941 1/20 0.31
▸ KIF11 P52732 1/20 0.31
▸ HSD11B1 P28845 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
SCHEMBL12320562 0.94 CYP2A6 (0.35) CYP2A6PRKCIPIK3CBKIF11HSD11B1
SCHEMBL12320518 0.90 KIF11 (0.36) KIF11
SCHEMBL12320558 0.84 KIF11 (0.36) KIF11
SCHEMBL12278046 0.83 KIF11 (0.32) KIF11
SCHEMBL12278750 0.82 CYP2A6 (0.47) CYP2A6PRKCIPIK3CBHSD11B1
SCHEMBL12278814 0.81 CYP2A6 (0.37) CYP2A6PRKCIPIK3CBCCNE2CDK4
SCHEMBL12278116 0.80 CYP2A6 (0.38) CYP2A6PRKCIPIK3CBHSD11B1
SCHEMBL12278654 0.77 KIF11 (0.32) KIF11
SCHEMBL12278811 0.77 CA2 (0.38) CYP2A6PRKCIPIK3CB
SCHEMBL12278926 0.77 CYP2A6 (0.34) CYP2A6PRKCIPIK3CB

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
US-8785915-B2 Compound for organic thin film transistor and organic thin film transistor using the same IDEMITSU KOSAN CO., LTD. (JP) 2014-07-22 — — US disclosed
US-20110210319-A1 COMPOUND FOR ORGANIC THIN FILM TRANSISTOR AND ORGANIC THIN FILM TRANSISTOR USING THE SAME COMPOUND FOR ORGANIC THIN FLIM TRANSISTOR AND ORGANIC THAN FLIM TRANSITOR USING THE SAME (JP) 2011-09-01 — — 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-20110210319-A1 COMPOUND FOR ORGANIC THIN FILM TRANSISTOR AND ORGANIC THIN FILM TRANSISTOR USING THE SAME OR10J3, TCF4, CTCF CYP2A6 864/4885PRKCI 4737/4885PIK3CB 3879/4885

“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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