SCHEMBL7462252

SCHEMBL7462252

CCCCCCCCCCC[CH]NC

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.48
THRB P10828 1/20 0.44
EPHX1 P07099 2/20 0.43
FAAH O00519 2/20 0.42
TRPV1 Q8NER1 1/20 0.42
DNM1 Q05193 3/20 0.41
ADH1B P00325 1/20 0.39
ADH1C P00326 1/20 0.39
ADH1A P07327 1/20 0.39
ADH4 P08319 1/20 0.39
ADH7 P40394 1/20 0.39
EP300 Q09472 1/20 0.38
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL7458873 1.00 TSHR (0.48) TSHRTHRBEPHX1FAAHTRPV1
SCHEMBL6672534 1.00 TSHR (0.48) TSHRTHRBEPHX1FAAHTRPV1
SCHEMBL5142056 1.00 TSHR (0.48) TSHRTHRBEPHX1FAAHTRPV1
SCHEMBL385794 1.00 TSHR (0.48) TSHRTHRBEPHX1FAAHTRPV1
SCHEMBL386575 1.00 TSHR (0.48) TSHRTHRBEPHX1FAAHTRPV1
SCHEMBL8102175 1.00 TSHR (0.48) TSHRTHRBEPHX1FAAHTRPV1
SCHEMBL387549 1.00
SCHEMBL16892581 1.00 TSHR (0.48) TSHRTHRBEPHX1FAAHTRPV1
SCHEMBL386565 1.00 TSHR (0.48) TSHRTHRBEPHX1FAAHTRPV1
SCHEMBL7453815 1.00 TSHR (0.48) TSHRTHRBEPHX1FAAHTRPV1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2894685-B1 BENZOTHIENOBENZOTHIOPHENE DERIVATIVE, ORGANIC SEMICONDUCTOR MATERIAL, AND ORGANIC TRANSISTOR DAINIPPON INK & CHEMICALS (JP) 2018-10-31 EP disclosed
US-9490433-B2 Benzothienobenzothiophene derivative, organic semiconductor material, and organic transistor DIC CORPORATION (JP) 2016-11-08 US disclosed
US-20150228913-A1 BENZOTHIENOBENZOTHIOPHENE DERIVATIVE, ORGANIC SEMICONDUCTOR MATERIAL, AND ORGANIC TRANSISTOR DIC CORPORATION (JP) 2015-08-13 US disclosed
EP-2894685-A1 BENZOTHIENOBENZOTHIOPHENE DERIVATIVE, ORGANIC SEMICONDUCTOR MATERIAL, AND ORGANIC TRANSISTOR DIC Corporation (JP) 2015-07-15 EP disclosed
EP-1263795-A1 METHOD FOR PRODUCING POLYMERS BASF AKTIENGESELLSCHAFT (DE) 2002-12-11 EP disclosed
EP-1167375-A1 ERYTHROMYCIN DERIVATIVES HOKURIKU SEIYAKU CO., LTD. (JP) 2002-01-02 EP disclosed
WO-2001066602-A1 METHOD FOR PRODUCING POLYMERS BASF AKTIENGESELLSCHAFT (DE) 2001-09-13 WO 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-20150228913-A1 BENZOTHIENOBENZOTHIOPHENE DERIVATIVE, ORGANIC SEMICONDUCTOR MATERIAL, AND ORGANIC TRANSISTOR TST, TPST2, TPR TSHR 2341/4885THRB 1550/4885EPHX1 3457/4885

“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.