SCHEMBL17201829

SCHEMBL17201829

COc1ccc(Nc2ccccc2OC)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.71
ALDH1A1 P00352 5/20 0.71
MAPK1 P28482 3/20 0.71
L3MBTL1 Q9Y468 2/20 0.71
RAB9A P51151 5/20 0.64
GAA P10253 5/20 0.64
KDM4E B2RXH2 2/20 0.64
THRB P10828 2/20 0.64
RECQL P46063 2/20 0.64
TDP1 Q9NUW8 2/20 0.64
HTT P42858 2/20 0.64
MEN1 O00255 2/20 0.64
KMT2A Q03164 2/20 0.64
MMP14 P50281 1/20 0.64
ALOX12 P18054 1/20 0.64
HSD17B10 Q99714 1/20 0.64
NPC1 O15118 3/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
NPSR1 Q6W5P4 1/20 0.59
AKR1C3 P42330 1/20 0.53

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
SCHEMBL30741238 1.00 MAPT (0.71) MAPTALDH1A1MAPK1L3MBTL1RAB9A
SCHEMBL5923796 0.92 MAPT (0.81) MAPTALDH1A1MAPK1L3MBTL1RAB9A
SCHEMBL1921461 0.88 RAB9A (0.72) MAPTALDH1A1MAPK1L3MBTL1RAB9A
SCHEMBL1920776 0.86 MAPT (0.73) MAPTALDH1A1MAPK1L3MBTL1RAB9A
SCHEMBL29744518 0.86 MAPT (0.72) MAPTALDH1A1MAPK1L3MBTL1RAB9A
SCHEMBL2095055 0.86 MAPT (0.72) MAPTALDH1A1MAPK1L3MBTL1RAB9A
SCHEMBL10480096 0.85 MAPT (0.71) MAPTALDH1A1MAPK1L3MBTL1RAB9A
SCHEMBL15883217 0.85 ALDH1A1 (0.71) MAPTALDH1A1MAPK1L3MBTL1RAB9A
SCHEMBL27546857 0.84 MAPT (0.73) MAPTALDH1A1MAPK1L3MBTL1RAB9A
Hydrochloric Acid SCHEMBL7128944 0.84 MAPT (0.70) MAPTALDH1A1MAPK1L3MBTL1RAB9A

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
CN-117924152-A Asymmetric hole transport material, preparation method thereof and application thereof in perovskite solar cell 江苏大学 2024-04-26 CN claimed
CN-110218296-B Structure, synthesis and application of carbazole polymer hole transport material 南京工业大学 2022-02-18 CN claimed
CN-117924152-A Asymmetric hole transport material, preparation method thereof and application thereof in perovskite solar cell 江苏大学 2024-04-26 CN disclosed
CN-110218296-B Structure, synthesis and application of carbazole polymer hole transport material 南京工业大学 2022-02-18 CN disclosed
US-9437825-B2 Hole-transporting material for inorganic/organic hybrid perovskite solar cells KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2016-09-06 US disclosed
US-20150311440-A1 HOLE-TRANSPORTING MATERIAL FOR INORGANIC/ORGANIC HYBRID PEROVSKITE SOLAR CELLS KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2015-10-29 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-20150311440-A1 HOLE-TRANSPORTING MATERIAL FOR INORGANIC/ORGANIC HYBRID PEROVSKITE SOLAR CELLS SLCO4C1, SLC9A2, SLCO2A1 MAPT 831/4885ALDH1A1 3094/4885MAPK1 2360/4885

“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.