SCHEMBL16807720

SCHEMBL16807720

CCC(C)c1ccc2c(ccc3c4cc5oc6c7ccc(C(C)CC)cc7ccc6c5cc4oc23)c1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.37
▸ HPGD P15428 2/20 0.37
▸ USP2 O75604 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ HDAC4 P56524 1/20 0.33
▸ HDAC2 Q92769 1/20 0.33
▸ HDAC8 Q9BY41 1/20 0.33
▸ ABCB11 O95342 1/20 0.33
▸ SCN10A Q9Y5Y9 1/20 0.32
▸ POLB P06746 1/20 0.31
▸ IGLV6-57 P01721 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
SCHEMBL16807646 0.81 ALDH1A1 (0.39) ALDH1A1HPGDUSP2GAAPKM
SCHEMBL16806137 0.80 ALDH1A1 (0.43) ALDH1A1HPGDUSP2GAAPKM
SCHEMBL16806144 0.77 ALDH1A1 (0.43) ALDH1A1HPGDUSP2GAAPKM
SCHEMBL22739431 0.75 TBK1 (0.33) ALDH1A1HPGDIGLV6-57
SCHEMBL24906570 0.74 PTPN1 (0.43) ALDH1A1HPGDALOX15HSD17B10
SCHEMBL9167387 0.74 ALDH1A1 (0.53) ALDH1A1HPGDUSP2GAAPKM
SCHEMBL22739444 0.72 UGT2B7 (0.33) ALDH1A1
SCHEMBL14295015 0.72 ALDH1A1 (0.42) ALDH1A1HPGDUSP2GAAPKM
SCHEMBL22742443 0.72 UGT2B7 (0.35) ALDH1A1HPGDALOX15HSD17B10
SCHEMBL22742200 0.71 TBK1 (0.32) IGLV6-57

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 4 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-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
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 ALDH1A1 1934/4885HPGD 4610/4885USP2 3662/4885

“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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