SCHEMBL3873166

SCHEMBL3873166

CCCc1cc2c(OC)c(c1)Cc1cc(CCC)cc(c1OC)Cc1cc(CCC)cc(c1OCCO)Cc1cc(CCC)cc(c1OC)C2

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 6/20 0.40
CD14 P08571 6/20 0.40
LY96 Q9Y6Y9 6/20 0.40
MGAM O43451 3/20 0.35
GAA P10253 3/20 0.35
SI P14410 3/20 0.35
MGAM2 Q2M2H8 3/20 0.35
TUBB1 Q9H4B7 1/20 0.34
KCNH2 Q12809 1/20 0.33
TMEM97 Q5BJF2 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
S1PR1 P21453 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
CNR1 P21554 2/20 0.32
CNR2 P34972 2/20 0.32
PTPRC P08575 1/20 0.32

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
SCHEMBL13686090 0.86 TLR4 (0.38) TLR4CD14LY96THRATHRB
SCHEMBL3877397 0.81 PTPRB (0.40) TUBB1ALDH1A1CYP3A4TNKS2CNR1
SCHEMBL13686489 0.81 HTR1A (0.39) TLR4CD14LY96MGAMGAA
SCHEMBL5954081 0.72 THRB (0.54) THRATHRBALDH1A1S1PR1
SCHEMBL14617493 0.69 ELANE (0.53) TLR4CD14LY96MGAMGAA
SCHEMBL1470772 0.68 TLR4 (0.36) TLR4CD14LY96TNKS2
SCHEMBL3875014 0.67 PTPRB (0.48) GAAALDH1A1CYP3A4CNR1CNR2
SCHEMBL22353258 0.67 TNKS2 (0.54) KCNH2TMEM97SIGMAR1TNKS2CNR1
SCHEMBL6395446 0.65 MAPT (0.39) CYP3A4
SCHEMBL18126784 0.65 TDP1 (0.54) TUBB1CNR1CNR2

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-7585928-B2 monomers of acetylenic homo- or copolymers; cured polymers has low dielectric constant as insulating layers in microelectronic devices DOW GLOBAL TECHNOLOGIES (US) 2009-09-08 US disclosed
US-7585928-B2 monomers of acetylenic homo- or copolymers; cured polymers has low dielectric constant as insulating layers in microelectronic devices DOW GLOBAL TECHNOLOGIES (US) 2009-09-08 US disclosed
US-20070027278-A1 Multifunctional monomers containing bound mesogenic poragen forming moieties and polyarylene compositions therefrom DOW GLOBAL TECHNOLOGIES LLC 2007-02-01 US disclosed
US-20070027278-A1 Multifunctional monomers containing bound mesogenic poragen forming moieties and polyarylene compositions therefrom DOW GLOBAL TECHNOLOGIES LLC 2007-02-01 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-20070027278-A1 Multifunctional monomers containing bound mesogenic poragen forming moieties and polyarylene compositions therefrom LRBA, CD74, BMP2 TLR4 2473/4885CD14 38/4885LY96 630/4885

“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.