SCHEMBL16807606

SCHEMBL16807606

CCCC/C=C/c1ccc2cc3c(cc2c1)oc1cc2c(cc13)oc1cc3cc(/C=C/CCCC)ccc3cc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
TNNC1 P63316 1/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA3 P07451 1/20 0.31
CA4 P22748 1/20 0.31
CA6 P23280 1/20 0.31
CA7 P43166 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CA5B Q9Y2D0 1/20 0.31
APP P05067 2/20 0.31
PDE5A O76074 1/20 0.31
ATP4A P20648 2/20 0.31
ATP4B P51164 2/20 0.31
DYRK1A Q13627 1/20 0.31
NQO2 P16083 1/20 0.31
FAAH O00519 2/20 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
SCHEMBL16806121 0.80 TNNC1 (0.41) TNNC1FAAHCES1
SCHEMBL29084177 0.77 HDAC1 (0.56) HDAC1HDAC8NQO2
SCHEMBL29084182 0.77 HDAC1 (0.56) HDAC1HDAC8NQO2
SCHEMBL8993815 0.72 CYP2A6 (0.50) HDAC1HDAC8TNNC1CA12CA2
SCHEMBL8993825 0.72 CYP2A6 (0.50) HDAC1HDAC8TNNC1CA12CA2
SCHEMBL16024625 0.72 PTPN1 (0.42) CA1CA2
SCHEMBL17489597 0.71 HDAC1 (0.36) HDAC1HDAC8TNNC1APPPDE5A
SCHEMBL20388826 0.71 HDAC1 (0.36) HDAC1HDAC8TNNC1APPPDE5A
SCHEMBL20044969 0.71 HDAC1 (0.33) HDAC1HDAC8
SCHEMBL10861862 0.71 HDAC1 (0.46) HDAC1HDAC8TNNC1APPFAAH

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 HDAC1 2132/4885HDAC8 3864/4885TNNC1 2039/4885

“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.