SCHEMBL8517640

SCHEMBL8517640

OCCCCCCCCCc1ccccc1O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.58
TAAR1 Q96RJ0 1/20 0.54
MPO P05164 5/20 0.53
SLC6A4 P31645 2/20 0.53
HSPA5 P11021 1/20 0.50
CA12 O43570 4/20 0.47
CA2 P00918 4/20 0.47
CA9 Q16790 4/20 0.47
BID P55957 1/20 0.46
BCL2L1 Q07817 1/20 0.46
MCL1 Q07820 1/20 0.46
BAK1 Q16611 1/20 0.46
GAA P10253 1/20 0.45
TSHR P16473 2/20 0.45
CYP2D6 P10635 1/20 0.45
HIF1A Q16665 1/20 0.45
HTR1A P08908 1/20 0.44
HRH3 Q9Y5N1 1/20 0.44
KDM4E B2RXH2 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL10522207 1.00 MGLL (0.58) MGLLTAAR1MPOSLC6A4HSPA5
SCHEMBL13446845 1.00 MGLL (0.58) MGLLTAAR1MPOSLC6A4HSPA5
SCHEMBL8618791 1.00 MGLL (0.58) MGLLTAAR1MPOSLC6A4HSPA5
SCHEMBL8055362 1.00 MGLL (0.58) MGLLTAAR1MPOSLC6A4HSPA5
SCHEMBL8526141 1.00 MGLL (0.58) MGLLTAAR1MPOSLC6A4HSPA5
SCHEMBL166339 0.98 TAAR1 (0.56) MGLLTAAR1MPOSLC6A4HSPA5
SCHEMBL169275 0.91 TAAR1 (0.58) MGLLTAAR1MPOSLC6A4HSPA5
SCHEMBL8401990 0.91 MGLL (0.66) MGLLTAAR1MPOSLC6A4HSPA5
SCHEMBL8402231 0.91 MGLL (0.66) MGLLTAAR1MPOSLC6A4HSPA5
SCHEMBL8398317 0.91 MGLL (0.66) MGLLTAAR1MPOSLC6A4HSPA5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5958392-A HAIR CONNDITIONERS COMPRISING A BLEND OF AMPHOTERIC ADDITION POLYMERS CONTAINING AMINE AND CARBOXY OR SULFO GROUPS AND A QUAATERNIZED VINYLPYRROLIDONE/AMINOALCOHOL ACRYLATE COPOLYMER; SOFTNESS; SILKY FEEL L'OREAL (FR) 1999-09-28 US disclosed
US-4996059-A Shampoos, conditioners and cosmetics; softness, hold and texture L'OREAL (FR) 1991-02-26 US disclosed
US-4985042-A New substituted metaaminophenols, a process for their preparation, hair-dyeing compositions containing them and a hair-dyeing process L'OREAL (FR) 1991-01-15 US disclosed
US-4954131-A Substituted metaaminophenols, a process for their preparation, hair-dyeing compositions containing them and a hair-dyeing process L'OREAL (FR) 1990-09-04 US disclosed