SCHEMBL8664622

SCHEMBL8664622

CCC(N)(O)c1ccccc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
ALDH1A1 P00352 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
ALOX15 P16050 2/20 0.36
CA2 P00918 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
CA12 O43570 1/20 0.36
GMNN O75496 1/20 0.36
EGFR P00533 1/20 0.36
LMNA P02545 1/20 0.36
FYN P06241 1/20 0.36
POLB P06746 1/20 0.36
CA3 P07451 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
MMP9 P14780 1/20 0.36
HPGD P15428 1/20 0.36
NFKB1 P19838 1/20 0.36
CA4 P22748 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
SCHEMBL1822446 0.81 TSHR (0.52) TSHRALDH1A1TDP1ALOX15CA2
SCHEMBL6672227 0.81 TSHR (0.52) TSHRALDH1A1TDP1ALOX15CA2
SCHEMBL7172700 0.79 TSHR (0.56) TSHRALDH1A1TDP1ALOX15CA2
SCHEMBL19214742 0.79 TSHR (0.56) TSHRALDH1A1TDP1ALOX15CA2
SCHEMBL9327070 0.78 TSHR (0.54) TSHRALDH1A1TDP1ALOX15CA2
SCHEMBL9308101 0.78 TSHR (0.54) TSHRALDH1A1TDP1ALOX15CA2
SCHEMBL7550163 0.77 ALDH1A1 (0.58) TSHRALDH1A1TDP1ALOX15CA2
SCHEMBL11139625 0.76 ALDH1A1 (0.47) TSHRALDH1A1TDP1CYP3A4MAPT
SCHEMBL6522579 0.76 TSHR (0.56) TSHRALDH1A1TDP1ALOX15CA2
SCHEMBL980707 0.76 TSHR (0.56) TSHRALDH1A1TDP1ALOX15CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104411293-A Hair colorant compositions comprising 2-methoxymethyl-1, 4-diaminobenzene and 2, 6-dihydroxyethylaminotoluene, methods and kits comprising the same PROCTER & GAMBLE 2015-03-11 CN disclosed
EP-0863927-A1 RAPID-FOAMING FOAM FOR PREFABRICATED SYSTEM BUILDING RATHOR AG (CH) 1998-09-16 EP disclosed
WO-1997020876-A1 RAPID-FOAMING FOAM FOR PREFABRICATED SYSTEM BUILDING RATHOR AG (CH) 1997-06-12 WO disclosed