SCHEMBL18979277

SCHEMBL18979277

CCCCCCCC(c1ccccc1)[Si](OC)(OC)OC

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.40
KCNH2 Q12809 2/20 0.39
CSNK1E P49674 1/20 0.39
CYP19A1 P11511 3/20 0.38
ALDH1A1 P00352 2/20 0.38
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
OPRL1 P41146 1/20 0.38
NAAA Q02083 2/20 0.38
SIGMAR1 Q99720 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
ASAH1 Q13510 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
SCHEMBL18979315 1.00 HTR2A (0.40) HTR2AKCNH2CSNK1ECYP19A1ALDH1A1
SCHEMBL9395955 1.00 HTR2A (0.40) HTR2AKCNH2CSNK1ECYP19A1ALDH1A1
SCHEMBL9398012 1.00 HTR2A (0.40) HTR2AKCNH2CSNK1ECYP19A1ALDH1A1
SCHEMBL9398133 1.00 HTR2A (0.40) HTR2AKCNH2CSNK1ECYP19A1ALDH1A1
SCHEMBL16293299 0.98 SIGMAR1 (0.39) HTR2AKCNH2CSNK1ECYP19A1ALDH1A1
SCHEMBL9398039 0.93 POLB (0.40) HTR2AKCNH2ALDH1A1OPRM1OPRD1
SCHEMBL2820240 0.86 AOC3 (0.40) HTR2AALDH1A1OPRM1OPRD1OPRK1
SCHEMBL28788341 0.85 HTR2A (0.39) HTR2AKCNH2CSNK1ECYP19A1ALDH1A1
SCHEMBL28899879 0.85 HTR2A (0.39) HTR2AKCNH2CSNK1ECYP19A1ALDH1A1
SCHEMBL28848140 0.83 HRH1 (0.47) HTR2A

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-20180219160-A1 BENZOBIS(THIADIAZOLE) DERIVATIVE, INK COMPRISING THE SAME, AND ORGANIC ELECTRONIC DEVICE USING THE SAME UBE INDUSTRIES, LTD. (JP) 2018-08-02 US disclosed
EP-3181569-A1 BENZOBIS(THIADIAZOLE) DERIVATIVE, INK CONTAINING SAME, AND ORGANIC ELECTRONIC DEVICE USING SAME UBE Industries, Ltd. (JP) 2017-06-21 EP 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-20180219160-A1 BENZOBIS(THIADIAZOLE) DERIVATIVE, INK COMPRISING THE SAME, AND ORGANIC ELECTRONIC DEVICE USING THE SAME IKZF3, HELZ, TEC HTR2A 4267/4885KCNH2 633/4885CSNK1E 1310/4885

“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.