SCHEMBL1610571

SCHEMBL1610571

CCCCCC/C=[C]\c1c(C)cccc1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.36
KCNH2 Q12809 3/20 0.35
TLR8 Q9NR97 2/20 0.35
GPR84 Q9NQS5 1/20 0.34
TSHR P16473 2/20 0.33
MMP2 P08253 2/20 0.33
F7 P08709 2/20 0.33
F3 P13726 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
ECE1 P42892 1/20 0.33
SGMS1 Q86VZ5 1/20 0.33
SGMS2 Q8NHU3 1/20 0.33
MUS81 Q96NY9 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SAE1 Q9UBE0 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
P2RX7 Q99572 1/20 0.33

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
SCHEMBL1610837 0.98 TLR8 (0.36) FAAHKCNH2TLR8GPR84TSHR
SCHEMBL1610827 0.93 TLR8 (0.30) TLR8
SCHEMBL1612728 0.85 CYP1A2 (0.32) TSHR
SCHEMBL1609758 0.84 TSHR (0.32) TSHR
SCHEMBL1610703 0.82 TSHR (0.33) FAAHTSHRCNR2
SCHEMBL1610527 0.82
SCHEMBL1609952 0.81 CNR1 (0.35) FAAHKCNH2TLR8GPR84TSHR
SCHEMBL1611147 0.81 TSHR (0.38) FAAHTSHRKDM4EMAPTHSD17B10
SCHEMBL1611128 0.80 SIRT2 (0.31) TSHR
SCHEMBL1610884 0.79 TSHR (0.35) FAAHKCNH2TLR8TSHRCNR1

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-20110087034-A1 Organic Semiconductor Material SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2011-04-14 US disclosed
EP-2248818-A1 ORGANIC SEMICONDUCTOR MATERIAL Sumitomo Chemical Company, Limited (JP) 2010-11-10 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-20110087034-A1 Organic Semiconductor Material OR10J3, TST, OR51E2 FAAH 4640/4885KCNH2 92/4885TLR8 4323/4885

“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.