SCHEMBL5669762

SCHEMBL5669762

CC[C@](O)(C(=O)O)N(O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.44
KMT2A Q03164 6/20 0.44
LMNA P02545 3/20 0.44
HTT P42858 2/20 0.44
GLA P06280 1/20 0.44
TSHR P16473 1/20 0.44
MEN1 O00255 4/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
RIPK1 Q13546 2/20 0.40
TP53 P04637 1/20 0.40
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MAPT P10636 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KDM4E B2RXH2 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 1/20 0.37

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
SCHEMBL5669770 1.00 ALDH1A1 (0.44) ALDH1A1KMT2ALMNAHTTGLA
SCHEMBL421668 0.83 NPSR1 (0.39) ALDH1A1KMT2ALMNAHTTGLA
SCHEMBL6180241 0.83 NPSR1 (0.39) ALDH1A1KMT2ALMNAHTTGLA
SCHEMBL25251559 0.81 ALDH1A1 (0.40) ALDH1A1KMT2ALMNAHTTGLA
SCHEMBL6834107 0.80 SMN1; SMN2 (0.47) ALDH1A1KMT2ALMNAHTTGLA
SCHEMBL27500132 0.75 KMT2A (0.44) ALDH1A1KMT2ALMNAHTTGLA
SCHEMBL625122 0.75 KMT2A (0.44) ALDH1A1KMT2ALMNAHTTGLA
SCHEMBL14691647 0.74 NPSR1 (0.44) ALDH1A1KMT2ALMNAHTTGLA
SCHEMBL2218949 0.71 ALDH1A1 (0.40) ALDH1A1KMT2ALMNAHTTGLA
SCHEMBL8580051 0.71 ALDH1A1 (0.40) ALDH1A1KMT2ALMNAHTTGLA

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-7026275-B2 Method of reducing photoelectric device leakage current in conjugated polymer and conjugated polymer composition INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE (TW) 2006-04-11 US disclosed
US-20040250849-A1 Method of reducing photoelectric device leakage current in conjugated polymer and conjugated polymer composition INDUSTRIAL TECHNOLOGY RESEARCH INSTITUTE 2004-12-16 US disclosed