SCHEMBL17877143

SCHEMBL17877143

Brc1ccc(-c2ccc3c(c2)-c2ccccc2[Si]3(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
MAPK1 P28482 1/20 0.44
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
MAPT P10636 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
APAF1 O14727 1/20 0.35
LMNA P02545 1/20 0.35
THRB P10828 1/20 0.35
XBP1 P17861 1/20 0.35
PTBP1 P26599 1/20 0.35
HTT P42858 1/20 0.35
GALK1 P51570 1/20 0.35
BLM P54132 1/20 0.35
SMAD3 P84022 1/20 0.35
ATM Q13315 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 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
SCHEMBL14410446 0.87 MEN1 (0.41) ALDH1A1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL30753777 0.86 PTPRC (0.40) ALDH1A1MAPK1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL17791418 0.86 PTPRC (0.40) ALDH1A1MAPK1RAB9ASMN1; SMN2L3MBTL1
SCHEMBL10042918 0.85 MEN1 (0.38) NPC1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL25937361 0.85 PTPRC (0.43) ALDH1A1MAPK1L3MBTL1PTPRCTDP1
SCHEMBL31040329 0.84 ALDH1A1 (0.40) ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2
SCHEMBL20138901 0.84 ALDH1A1 (0.40) ALDH1A1MAPK1NPC1RAB9ASMN1; SMN2
SCHEMBL24123214 0.84 CYP1A2 (0.44) ALDH1A1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL22949569 0.81 MEN1 (0.39) ALDH1A1NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL17791383 0.81 MAPT (0.37) ALDH1A1NPC1RAB9ASMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160190487-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 US disclosed
US-20160190487-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-30 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-20160190487-A1 MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME MAOA, MAOB, COMT ALDH1A1 38/4885MAPK1 421/4885NPC1 2184/4885

“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.