SCHEMBL10028197

SCHEMBL10028197

c1cc2ccc3oc4cc(-c5ccc(-c6cc7ccc8oc9cccc%10ccc%11oc(c6)c7c8-c%11c%109)c6ccccc56)cc5ccc6oc(c1)c2c3-c6c54

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 4/20 0.38
CYP1A2 P05177 3/20 0.38
FYN P06241 2/20 0.38
ERBB2 P04626 1/20 0.38
MAOA P21397 1/20 0.38
ACHE P22303 1/20 0.38
ABCG2 Q9UNQ0 4/20 0.36
PAX8 Q06710 2/20 0.36
CYP1A1 P04798 1/20 0.36
MAPK3 P27361 1/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
THRB P10828 1/20 0.36
HSD17B10 Q99714 1/20 0.36
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
MEN1 O00255 2/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 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
SCHEMBL10028088 0.91 MEN1 (0.40) AHRCYP1A2FYNMAOAABCG2
SCHEMBL10028203 0.89 CYP1A2 (0.39) AHRCYP1A2FYNERBB2MAOA
SCHEMBL10028196 0.88 MAOA (0.38) AHRCYP1A2FYNERBB2MAOA
SCHEMBL10028189 0.87 CYP1A2 (0.36) AHRCYP1A2FYNERBB2MAOA
SCHEMBL10028086 0.85 CYP1A2 (0.37) AHRCYP1A2FYNMAOAACHE
SCHEMBL10028089 0.85 AHR (0.37) AHRCYP1A2FYNABCG2PAX8
SCHEMBL10028190 0.84 PGR (0.37) AHRCYP1A2FYNERBB2MAOA
SCHEMBL10028081 0.80 PGR (0.39) AHRCYP1A2FYNABCG2PAX8
SCHEMBL10028092 0.79 ACVR1 (0.41) CYP1A2ALDH1A1HPGDHSD17B10NPC1
SCHEMBL29737512 0.78 ALDH1A1 (0.48) AHRCYP1A2MAOACYP1A1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046915-B1 NEW MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2015-12-02 EP disclosed
US-8114531-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2012-02-14 US disclosed
US-8114531-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2012-02-14 US disclosed
US-20100013381-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-01-21 US disclosed
US-20100013381-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-01-21 US disclosed
WO-2008011964-A1 NEW MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2008-01-31 WO 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-20100013381-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, SOD1, SLC40A1 AHR 2429/4885CYP1A2 1150/4885FYN 3018/4885

“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.