SCHEMBL14703879

SCHEMBL14703879

CCCCCCC1(O)c2nc(c(-c3cccc(OC)c3)c3ccc([nH]3)c(-c3cccc(OC)c3)c3nc(c(-c4cccc(OC)c4)c4ccc([nH]4)c2-c2cccc(OC)c2)C=C3)C1(O)CCCCC

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GCGR P47871 1/20 0.41
▸ TLR8 Q9NR97 1/20 0.39
▸ CNR1 P21554 1/20 0.36
▸ CNR2 P34972 1/20 0.36
▸ CYCS P99999 1/20 0.35
▸ GRIN1 Q05586 1/20 0.35
▸ GRIN2A Q12879 1/20 0.35
▸ FPR1 P21462 1/20 0.35
▸ TERT O14746 2/20 0.35
▸ APLNR P35414 1/20 0.35
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC2 Q92769 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.35
▸ EPHX2 P34913 2/20 0.34
▸ ABCG2 Q9UNQ0 1/20 0.34

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
SCHEMBL17166508 1.00 GCGR (0.41) GCGRTLR8CNR1CNR2CYCS
SCHEMBL17166280 0.95 GCGR (0.40) GCGRTLR8CNR1CNR2CYCS
SCHEMBL14701519 0.95 GCGR (0.40) GCGRTLR8CNR1CNR2CYCS
SCHEMBL14701527 0.87 GCGR (0.38) GCGRCYCSTERT
SCHEMBL19058790 0.87 GCGR (0.38) GCGRCYCSTERT
SCHEMBL14701520 0.87 GCGR (0.38) GCGRCYCSTERT
SCHEMBL14703826 0.82 KDM4E (0.38) CYCSGRIN1GRIN2ATERTABCG2
SCHEMBL17681579 0.81 GCGR (0.51) GCGRTLR8CNR1CNR2GRIN1
SCHEMBL30081962 0.80 TERT (0.49) TERTABCG2
SCHEMBL433807 0.80 TERT (0.49) TERTABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130041307-A1 APPLICATION OF BETA-FUNCTIONALIZED DIHYDROXY-CHLORINS FOR PDT CERAMOPTEC INDUSTRIES, INC. 2013-02-14 — — 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-20130041307-A1 APPLICATION OF BETA-FUNCTIONALIZED DIHYDROXY-CHLORINS FOR PDT TK1, DHPS, DLD GCGR 4601/4885TLR8 85/4885CNR1 2313/4885

“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.

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