SCHEMBL16807705

SCHEMBL16807705

COCCOCCOCCOc1ccc2c(c1)oc1cc3c(cc12)oc1cc2cc(C)ccc2cc13

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 4/20 0.44
▸ ABCB1 P08183 2/20 0.44
▸ ABCC1 P33527 2/20 0.44
▸ APP P05067 2/20 0.43
▸ GRM4 Q14833 1/20 0.40
▸ MET P08581 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ MAOA P21397 1/20 0.38
▸ DYRK1A Q13627 1/20 0.38
▸ HDAC1 Q13547 1/20 0.38
▸ CA12 O43570 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ ACHE P22303 2/20 0.37
▸ MAOB P27338 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ MEN1 O00255 1/20 0.36

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
SCHEMBL26768364 0.77 MAPT (0.53) ABCG2ABCB1ABCC1APPMET
SCHEMBL16807626 0.77 CYP1A2 (0.47) KDM4EMAPK1CA12CA1CA9
SCHEMBL16807649 0.77 APP (0.38) APPGRM4KDM4EMAPK1TDP1
SCHEMBL16807667 0.77 APP (0.38) APPGRM4KDM4EMAPK1TDP1
SCHEMBL16807614 0.77 APP (0.38) APPGRM4KDM4EMAPK1TDP1
SCHEMBL15704195 0.76 CYP2A6 (0.50) KDM4EMAPK1TDP1MAOADYRK1A
SCHEMBL14926620 0.76 CYP2A6 (0.50) APPKDM4EMAPK1TDP1MAOA
SCHEMBL12433587 0.76 CYP2A6 (0.50) APPKDM4ETDP1DYRK1AMAOB
SCHEMBL18595900 0.76 CYP1A2 (0.54) KDM4ETDP1DYRK1AMAOBALDH1A1
SCHEMBL16807619 0.76 CYP1A2 (0.54) KDM4ETDP1DYRK1AMAOBALDH1A1

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-9586972-B2 Organic thin film transistor, organic semiconductor thin film, and organic semiconductor material FUJIFILM CORPORATION (JP) 2017-03-07 — — US disclosed
US-20150166560-A1 ORGANIC THIN FILM TRANSISTOR, ORGANIC SEMICONDUCTOR THIN FILM, AND ORGANIC SEMICONDUCTOR MATERIAL FUJIFILM CORPORATION (JP) 2015-06-18 — — 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-20150166560-A1 ORGANIC THIN FILM TRANSISTOR, ORGANIC SEMICONDUCTOR THIN FILM, AND ORGANIC SEMICONDUCTOR MATERIAL OR10J3, SLC19A1, SLCO2A1 ABCG2 337/4885ABCB1 246/4885ABCC1 401/4885

“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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