SCHEMBL17115378

SCHEMBL17115378

CCCCCCCCc1cc(-c2ccc3oc4ccc(-n5c6ccccc6c6cc(C#N)ccc65)cc4c3c2)cc(-n2c3ccccc3c3ccccc32)c1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
ICMT O60725 1/20 0.35
PTGER4 P35408 2/20 0.34
RORC P51449 5/20 0.33
PGR P06401 1/20 0.33
RORA P35398 1/20 0.33
RORB Q92753 1/20 0.33
HRH3 Q9Y5N1 1/20 0.31
FAAH O00519 1/20 0.30
TNKS O95271 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
SCHEMBL17115382 0.93 TSHR (0.42) TSHRHSD17B10ICMTPTGER4RORC
SCHEMBL17115366 0.92 TSHR (0.40) TSHRHSD17B10ICMTPTGER4RORC
SCHEMBL17115459 0.89 RORC (0.42) TSHRHSD17B10PTGER4RORCRORA
SCHEMBL17115483 0.88 CYP1A2 (0.42) TSHRHSD17B10PTGER4RORCRORA
SCHEMBL18707368 0.88 RORA (0.35) ICMTRORCPGRRORARORB
SCHEMBL17115487 0.88 CYP1A2 (0.42) TSHRHSD17B10PTGER4RORCRORA
SCHEMBL17115372 0.86 PTGER4 (0.32) PTGER4
SCHEMBL17115490 0.84 TNKS (0.40) PTGER4RORCPGRTNKS
SCHEMBL18030948 0.84 TNKS (0.40) PTGER4RORCPGRTNKS
SCHEMBL18713383 0.84 TNKS (0.40) PTGER4RORCPGRTNKS

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-20170098781-A1 NEW DIBENZOFURANS AND DIBENZOTHIOPHENES IDEMITSU KOSAN CO., LTD. (JP) 2017-04-06 US disclosed
WO-2015140073-A1 NEW DIBENZOFURANS AND DIBENZOTHIOPHENES IDEMITSU KOSAN CO., LTD. (JP) 2015-09-24 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-20170098781-A1 NEW DIBENZOFURANS AND DIBENZOTHIOPHENES DBF4, DDT, SLC43A3 TSHR 4317/4885HSD17B10 2557/4885ICMT 277/4885

“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.