SCHEMBL10028153

SCHEMBL10028153

c1ccc2c(-c3c4ccccc4c4ccc5oc6c(-c7cccc8ccccc78)c7ccccc7c7ccc8oc3c4c5-c8c67)cccc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
HPGD P15428 4/20 0.38
HSD17B10 Q99714 4/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
CYP1A2 P05177 1/20 0.37
THRB P10828 1/20 0.37
PSD A5PKW4 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
ARSA P15289 1/20 0.36
CDC25A P30304 1/20 0.36
CDC25C P30307 1/20 0.36
HPRT1 P00492 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
CASP1 P29466 1/20 0.35

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
SCHEMBL10028161 0.89 MCL1 (0.37) ALDH1A1HPGDHSD17B10MAPTMEN1
SCHEMBL10028143 0.88 ALDH1A1 (0.39) ALDH1A1HPGDHSD17B10MAPTMEN1
SCHEMBL10028162 0.80 CYP1A2 (0.39) ALDH1A1HPGDHSD17B10MAPTMEN1
SCHEMBL17944647 0.78 L3MBTL1 (0.46) ALDH1A1HPGDHSD17B10MAPTMEN1
SCHEMBL10028155 0.77 CA1 (0.37) ALDH1A1HPGDHSD17B10MAPTMEN1
SCHEMBL10028105 0.77 MAOA (0.43) ALDH1A1HPGDHSD17B10MAPTMEN1
SCHEMBL10028159 0.77 GRM4 (0.39) ALDH1A1HPGDHSD17B10MAPTCYP1A2
SCHEMBL10028206 0.76 MAOA (0.37) ALDH1A1HPGDHSD17B10MAPTMEN1
SCHEMBL10028183 0.76 MAOA (0.40) ALDH1A1HPGDHSD17B10MAPTMEN1
SCHEMBL17944871 0.76 AHR (0.40) ALDH1A1HPGDHSD17B10MAPTMEN1

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-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

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 ALDH1A1 220/4885HPGD 2997/4885HSD17B10 2763/4885

“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.