SCHEMBL3507940

SCHEMBL3507940

Oc1ccccc1COP(OCc1ccccc1O)OCc1ccccc1O

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.59
HSPA5 P11021 1/20 0.52
KEAP1 Q14145 1/20 0.47
TSHR P16473 2/20 0.46
CYP2D6 P10635 1/20 0.46
HIF1A Q16665 1/20 0.46
TAAR1 Q96RJ0 1/20 0.45
AKR1B1 P15121 1/20 0.45
CA12 O43570 5/20 0.43
CA2 P00918 5/20 0.43
CA9 Q16790 4/20 0.42
MPO P05164 1/20 0.42
KDM4E B2RXH2 1/20 0.41
HSD17B10 Q99714 1/20 0.41

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
SCHEMBL3507942 0.84 IDO1 (0.57) IDO1HSPA5KEAP1TSHRCYP2D6
SCHEMBL185874 0.83 IDO1 (0.55) IDO1HSPA5KEAP1TSHRCYP2D6
SCHEMBL185875 0.81 IDO1 (0.53) IDO1HSPA5KEAP1TSHRCYP2D6
SCHEMBL29152360 0.79 IDO1 (0.52) IDO1HSPA5KEAP1TSHRCYP2D6
SCHEMBL126999 0.78 IDO1 (0.67) IDO1HSPA5KEAP1TSHRCYP2D6
SCHEMBL497740 0.78 IDO1 (0.50) IDO1HSPA5KEAP1TSHRCYP2D6
SCHEMBL7101247 0.76 IDO1 (0.64) IDO1HSPA5KEAP1TSHRCYP2D6
SCHEMBL557812 0.74 IDO1 (0.61) IDO1HSPA5KEAP1TSHRCYP2D6
SCHEMBL11791488 0.74 IDO1 (0.61) IDO1HSPA5KEAP1TSHRCYP2D6
SCHEMBL14538248 0.74 IDO1 (1.00) IDO1HSPA5KEAP1TSHRCYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-6025493-A None JP disclosed
US-9156875-B2 Immune stimulatory oligoribonucleotide analogs containing modified oligophosphate moieties ADIUTIDE PHARMACEUTICALS GMBH (DE) 2015-10-13 US disclosed
EP-2207787-B1 IMMUNE STIMULATORY OLIGORIBONUCLEOTIDE ANALOGS CONTAINING MODIFIED OLIGOPHOSPHATE MOIETIES ADIUTIDE PHARMACEUTICALS GMBH (DE) 2014-11-12 EP disclosed
US-20130164333-A1 IMMUNE STIMULATORY OLIGORIBONUCLEOTIDE ANALOGS CONTAINING MODIFIED OLIGOPHOSPHATE MOIETIES ADIUTIDE PHARMACEUTICALS GMBH (DE) 2013-06-27 US disclosed
US-8349812-B2 Immune stimulatory oligoribonucleotide analogs containing modified oligophosphate moieties ADIUTIDE PHARMACEUTICALS GMBH (DE) 2013-01-08 US disclosed
US-20100260788-A1 Immune Stimulatory Oligoribonucleotide Analogs Containing Modified Oligophosphate Moieties DR. EUGEN UHLMANN (DE) 2010-10-14 US disclosed
EP-2207787-A2 IMMUNE STIMULATORY OLIGORIBONUCLEOTIDE ANALOGS CONTAINING MODIFIED OLIGOPHOSPHATE MOIETIES Uhlmann, Eugen (DE) 2010-07-21 EP disclosed
WO-2009060281-A2 IMMUNE STIMULATORY OLIGORIBONUCLEOTIDE ANALOGS CONTAINING MODIFIED OLIGOPHOSPHATE MOIETIES COLEY PHARMACEUTICAL GMBH (DE) 2009-05-14 WO disclosed
JP-H0625493-A THERMALLY STABLE CHLORINATED RESIN COMPOSITION AKISHIMA KAGAKU KOGYO KK 1994-02-01 JP 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-20100260788-A1 Immune Stimulatory Oligoribonucleotide Analogs Containing Modified Oligophosphate Moieties TLR3, TLR5, TLR9 IDO1 250/4885HSPA5 2089/4885KEAP1 2996/4885

“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.