SCHEMBL10145698

SCHEMBL10145698

CC(=O)CCc1ccc(N(C)c2cc3c(cc2Cl)C2(OC(=O)c4ccccc42)c2cc(Cl)c(O)cc2O3)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
FTO Q9C0B1 5/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
TDP1 Q9NUW8 3/20 0.43
HTT P42858 2/20 0.43
CYP2C19 P33261 2/20 0.43
RECQL P46063 2/20 0.43
BLM P54132 2/20 0.43
PRMT1 Q99873 2/20 0.43
ACE2 Q9BYF1 2/20 0.43
HPGD P15428 1/20 0.43
SMAD3 P84022 1/20 0.43
LMNA P02545 4/20 0.43
USP2 O75604 2/20 0.43
ALDH1A1 P00352 1/20 0.43
GSTP1 P09211 1/20 0.40
CYP3A4 P08684 2/20 0.39
POLB P06746 2/20 0.35
NPSR1 Q6W5P4 2/20 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
SCHEMBL10145602 0.93 MAPT (0.43) MAPTFTOMEN1KMT2ATDP1
SCHEMBL10145706 0.92 MAPT (0.43) MAPTFTOMEN1KMT2ATDP1
SCHEMBL10145700 0.91 MAPT (0.44) MAPTFTOMEN1KMT2ATDP1
SCHEMBL10145537 0.90 MAPT (0.41) MAPTFTOMEN1KMT2ATDP1
SCHEMBL10145477 0.87 MAPT (0.52) MAPTFTOMEN1KMT2ATDP1
SCHEMBL10145608 0.84 MAPT (0.49) MAPTFTOMEN1KMT2ATDP1
SCHEMBL13648698 0.83 MAPT (0.43) MAPTFTOMEN1KMT2ATDP1
SCHEMBL10145610 0.81 MEN1 (0.46) MAPTFTOMEN1KMT2ATDP1
SCHEMBL10145589 0.80 CYP3A4 (0.40) MAPTFTOMEN1KMT2ATDP1
SCHEMBL10145597 0.80 CYP3A4 (0.39) MAPTFTOMEN1KMT2ATDP1

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-8114904-B2 Luminescence quenchers and fluorogenic probes for detection of reactive species Versitech Limited & Morningside Ventures Limited (CN) 2012-02-14 US disclosed
WO-2009121247-A1 LUMINESCENCE QUENCHERS AND FLUOROGENIC PROBES FOR DETECTION OF REACTIVE SPECIES VERSITECH LIMITED (CN) 2009-10-08 WO disclosed