SCHEMBL3785185

SCHEMBL3785185

CC(C)(C)c1ccc2c(B(O)O)c3cc(C(C)(C)C)ccc3c(B(O)O)c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
HPGD P15428 1/20 0.43
ALOX15 P16050 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
TRPV1 Q8NER1 3/20 0.40
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
PKM P14618 1/20 0.39
RECQL P46063 1/20 0.39
KMT2A Q03164 1/20 0.39
KIF11 P52732 4/20 0.39
LMNA P02545 1/20 0.38
TYR P14679 1/20 0.38
HTR1D P28221 2/20 0.35
LRRK2 Q5S007 1/20 0.35
HTR1A P08908 1/20 0.35
HTR1B P28222 1/20 0.35
TSHR P16473 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
SCHEMBL14973252 0.94 KIF11 (0.47) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL28682657 0.81 KIF11 (0.40) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL29349699 0.81 KIF11 (0.40) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL19195719 0.74 ALDH1A1 (0.52) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL7525355 0.73 ALDH1A1 (0.42) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL12179581 0.73 POLB (0.46) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL10015432 0.72 ALDH1A1 (0.41) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL2703284 0.72 TNKS (0.40) ALDH1A1TRPV1MEN1KMT2AKIF11
SCHEMBL13433265 0.71 ALDH1A1 (0.43) ALDH1A1HPGDALOX15HSD17B10TDP1
SCHEMBL30304254 0.71 ALDH1A1 (0.43) ALDH1A1HPGDALOX15HSD17B10TDP1

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
CN-114105933-B Benzoxanthene organic compound, electroluminescent device and display device 阜阳欣奕华材料科技有限公司 2023-08-22 CN disclosed
CN-114105933-A Benzoxanthene organic compound, electroluminescent device and display device 阜阳欣奕华材料科技有限公司 2022-03-01 CN disclosed
US-8993123-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2015-03-31 US disclosed
US-20100327270-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2010-12-30 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-20100327270-A1 NOVEL MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES L1CAM, ELAVL1, EPCAM ALDH1A1 336/4885HPGD 2665/4885ALOX15 1659/4885

“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.