SCHEMBL5618360

SCHEMBL5618360

COc1cc(/C=C2/CCc3ccccc3C2=O)cc(Br)c1OC

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.84
SMN1; SMN2 Q16637 7/20 0.84
ALDH1A1 P00352 7/20 0.84
LMNA P02545 5/20 0.84
HTT P42858 2/20 0.84
MEN1 O00255 4/20 0.69
KMT2A Q03164 4/20 0.69
CASP3 P42574 2/20 0.69
SENP8 Q96LD8 2/20 0.69
SENP7 Q9BQF6 2/20 0.69
SENP6 Q9GZR1 2/20 0.69
HPGD P15428 1/20 0.69
MIF P14174 6/20 0.65
MAPK1 P28482 1/20 0.64
POLB P06746 1/20 0.61
RAB9A P51151 2/20 0.61
PLA2G1B P04054 1/20 0.61
ATG4B Q9Y4P1 1/20 0.61
NPC1 O15118 1/20 0.59
PKM P14618 1/20 0.59

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
SCHEMBL5618362 1.00 MAPT (0.84) MAPTSMN1; SMN2ALDH1A1LMNAHTT
SCHEMBL14454079 0.86 MAPT (0.63) MAPTSMN1; SMN2ALDH1A1LMNAHTT
SCHEMBL5573384 0.86 MAPT (0.63) MAPTSMN1; SMN2ALDH1A1LMNAHTT
SCHEMBL5573382 0.86 MAPT (0.63) MAPTSMN1; SMN2ALDH1A1LMNAHTT
SCHEMBL30967992 0.82 MAPT (1.00) MAPTSMN1; SMN2ALDH1A1LMNAHTT
SCHEMBL8547900 0.82 MAPT (1.00) MAPTSMN1; SMN2ALDH1A1LMNAHTT
SCHEMBL8547897 0.82 MAPT (1.00) MAPTSMN1; SMN2ALDH1A1LMNAHTT
SCHEMBL25609318 0.82 MAPT (1.00) MAPTSMN1; SMN2ALDH1A1LMNAHTT
SCHEMBL14800018 0.80 MAPT (0.79) MAPTSMN1; SMN2ALDH1A1LMNAHTT
SCHEMBL6954573 0.79 MAPT (0.81) MAPTSMN1; SMN2ALDH1A1LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7235674-B2 Substituted coumarins and quinolines and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2007-06-26 US disclosed
US-7015328-B2 Substituted coumarins and quinolines and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2006-03-21 US disclosed
US-20050090526-A1 Substituted coumarins and quinolines and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2005-04-28 US disclosed
EP-1392283-A4 SUBSTITUTED COUMARINS AND QUINOLINES AS CASPASE ACTIVATORS CYTOVIA INC (US) 2004-10-20 EP disclosed
EP-1392283-A1 SUBSTITUTED COUMARINS AND QUINOLINES AS CASPASES ACTIVATORS Cytovia, Inc. (US) 2004-03-03 EP disclosed
US-20030114485-A1 Substituted coumarins and quinolines and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. 2003-06-19 US disclosed
WO-2002092076-A1 SUBSTITUTED COUMARINS AND QUINOLINES AS CASPASES ACTIVATORS CYTOVIA, INC. (US) 2002-11-21 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 (2 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-20030114485-A1 Substituted coumarins and quinolines and analogs as activators of caspases and inducers of apoptosis and the use thereof CASP7, CASP1, CASP5 MAPT 4446/4885SMN1; SMN2 4828/4885ALDH1A1 1275/4885
US-20050090526-A1 Substituted coumarins and quinolines and analogs as activators of caspases and inducers of apoptosis and the use thereof CASP7, CASP5, CASP14 MAPT 4420/4885SMN1; SMN2 4847/4885ALDH1A1 1656/4885

“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.