SCHEMBL28050756

SCHEMBL28050756

Cc1cccc(CC(O)O)c1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.50
IDO1 P14902 2/20 0.48
ACHE P22303 2/20 0.46
CTBP2 P56545 1/20 0.43
PNMT P11086 1/20 0.42
POLB P06746 1/20 0.42
NR3C1 P04150 1/20 0.42
PGR P06401 1/20 0.42
NR3C2 P08235 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
ALDH1A1 P00352 1/20 0.41
CYP2D6 P10635 1/20 0.41
TSHR P16473 1/20 0.41

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
SCHEMBL8257853 0.85 TAAR1 (0.48) TAAR1IDO1ACHECTBP2PNMT
SCHEMBL14997302 0.85 TAAR1 (0.48) TAAR1IDO1ACHECTBP2PNMT
SCHEMBL26173261 0.83 TAAR1 (0.47) TAAR1IDO1ACHECTBP2POLB
SCHEMBL11827945 0.83 TAAR1 (0.52) TAAR1IDO1ACHECTBP2PNMT
SCHEMBL27729201 0.83 TAAR1 (0.47) TAAR1IDO1ACHECTBP2POLB
SCHEMBL9631389 0.83 TAAR1 (0.47) TAAR1IDO1ACHECTBP2POLB
SCHEMBL12136140 0.83 PNMT (0.62) TAAR1IDO1PNMT
SCHEMBL2563917 0.83 PNMT (0.62) TAAR1IDO1PNMT
SCHEMBL29968153 0.83 PNMT (0.62) TAAR1IDO1PNMT
SCHEMBL10249345 0.83 PNMT (0.62) TAAR1IDO1PNMT

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-110317559-A A kind of meta-xylene modified phenolic resin adhesive and preparation method thereof 广西大学 2019-10-11 CN disclosed
CN-105418868-B Boron modified phenolic resin, preparation method and friction material 山东圣泉新材料股份有限公司 2017-07-25 CN disclosed
CN-105418868-A Boron modified phenolic resin, preparation method and friction material SHANDONG SHENGQUAN NEW MAT CO LTD 2016-03-23 CN disclosed