SCHEMBL9876447

SCHEMBL9876447

CCCCCCCCCCCCCCCCCCCc1ccc2cc(C)ccc(OCCOCCOC)c1-2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.41
MAPT P10636 7/20 0.39
NPSR1 Q6W5P4 2/20 0.39
GAA P10253 1/20 0.39
THRB P10828 1/20 0.39
KDM4E B2RXH2 4/20 0.38
MEN1 O00255 5/20 0.38
KMT2A Q03164 5/20 0.38
MAPK1 P28482 4/20 0.38
RAD52 P43351 2/20 0.38
HTT P42858 2/20 0.38
L3MBTL1 Q9Y468 5/20 0.38
TDP1 Q9NUW8 2/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
CYP3A4 P08684 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
LMNA P02545 3/20 0.36

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
SCHEMBL9875998 0.82 ALOX5 (0.48) GAAL3MBTL1TDP1POLBALOX5
SCHEMBL9876234 0.80 ALOX5 (0.40) ALDH1A1MAPTTHRBMEN1KMT2A
SCHEMBL9876445 0.77 ALOX5 (0.34) ALDH1A1MAPTNPSR1GAATHRB
SCHEMBL9876444 0.74 HTR2A (0.36) ALDH1A1MAPTGAAMEN1KMT2A
SCHEMBL9875635 0.74 CASR (0.35) ALDH1A1MAPTNPSR1THRBMEN1
SCHEMBL9876488 0.73 CNR2 (0.39) MAPTNPSR1MEN1KMT2AMAPK1
SCHEMBL11215013 0.72 MAPT (0.61) ALDH1A1MAPTNPSR1GAATHRB
SCHEMBL9876120 0.72 MEN1 (0.46) MAPTTHRBMEN1KMT2AHTT
SCHEMBL13933167 0.71 MAPT (0.50) ALDH1A1MAPTNPSR1GAATHRB
SCHEMBL13933171 0.71 MAPT (0.50) ALDH1A1MAPTNPSR1GAATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5037575-A Photostability MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) 1991-08-06 US disclosed