SCHEMBL5284823

SCHEMBL5284823

Cc1ccc(OC(C)Oc2ccc(C(C)C)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.41
TEAD4 Q15561 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
MAPT P10636 3/20 0.39
ALDH1A1 P00352 2/20 0.39
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
BCHE P06276 1/20 0.38
RAB9A P51151 1/20 0.37
CHRNA7 P36544 1/20 0.37
HPGD P15428 1/20 0.37
XBP1 P17861 1/20 0.37
IDO1 P14902 2/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
NLRP1 Q9C000 1/20 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
SCHEMBL1162019 0.89 ACHE (0.50) ACHETEAD4SLC6A4MAPTALDH1A1
SCHEMBL5292439 0.83 NPC1 (0.42) SLC6A2SLC6A4SLC6A3MAPTALDH1A1
SCHEMBL15082378 0.82 MEN1 (0.43) ALDH1A1KMT2AMEN1RAB9AHPGD
SCHEMBL10030396 0.82 TEAD4 (0.60) ACHETEAD4SLC6A4MAPTALDH1A1
SCHEMBL5281813 0.81 ALDH1A1 (0.46) ACHESLC6A2SLC6A4SLC6A3ALDH1A1
P-Cymene SCHEMBL1697748 0.81 ACHE (0.53) ACHETDP1BCHECHRNA7IDO1
P-Cymene SCHEMBL1143 0.81 ACHE (0.53) ACHETDP1BCHECHRNA7IDO1
SCHEMBL14573522 0.80 ALDH1A1 (0.47) ACHEMAPTALDH1A1TDP1KMT2A
SCHEMBL3395724 0.80 MEN1 (0.46) ACHESLC6A4ALDH1A1KMT2AMEN1
SCHEMBL13899252 0.79 ACHE (0.52) ACHETEAD4SLC6A4MAPTALDH1A1

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
WO-2006138653-A9 THERMAL RECORDING MATERIALS AND METHODS OF MAKING AND USING THE SAME NASHUA CORP (US) 2007-03-01 WO disclosed
WO-2006138653-A1 THERMAL RECORDING MATERIALS AND METHODS OF MAKING AND USING THE SAME NASHUA CORPORATION (US) 2006-12-28 WO disclosed