SCHEMBL7130760

SCHEMBL7130760

CC(C)N1N=C(c2ccco2)C(O)(O)C1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
TSHR P16473 2/20 0.35
CBX7 O95931 1/20 0.34
CDYL2 Q8N8U2 1/20 0.34
CDYL Q9Y232 1/20 0.34
CDY1; CDY1B Q9Y6F8 1/20 0.34
KDM4E B2RXH2 5/20 0.34
TDP1 Q9NUW8 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
ALDH1A1 P00352 4/20 0.33
RXFP1 Q9HBX9 1/20 0.33
USP19 O94966 1/20 0.33
HPGD P15428 4/20 0.33
POLB P06746 4/20 0.33
PKM P14618 3/20 0.33
MAPT P10636 2/20 0.33
CDC25A P30304 1/20 0.33
CDC25C P30307 1/20 0.33
HSD17B10 Q99714 3/20 0.33

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
SCHEMBL6933167 0.81 KMT2A (0.39) NPC1RAB9ATSHRKDM4ETDP1
SCHEMBL6932452 0.77 TDP1 (0.34) NPC1RAB9ATSHRKDM4ETDP1
SCHEMBL6936608 0.75 ALDH1A1 (0.44) TSHRKDM4ETDP1L3MBTL1ALDH1A1
SCHEMBL6935599 0.70 PDE4A (0.43) MAPTHTTSMN1; SMN2CYP1A2CYP2C19
SCHEMBL6727677 0.69 MAOB (0.36) NPC1RAB9ATSHRKDM4ETDP1
SCHEMBL6928265 0.66 GAA (0.39) TDP1
SCHEMBL14993031 0.63 NPC1 (0.43) NPC1RAB9ATSHRKDM4ETDP1
SCHEMBL6930289 0.61 KDM4E (0.33) KDM4EALDH1A1USP19MAPTMAPK1
SCHEMBL6933456 0.59 GAA (0.30) TDP1
SCHEMBL1762773 0.58 CAMK2D (0.48) NPC1RAB9ATSHRKDM4ETDP1

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-5958382-A ARTIFICIAL TANNING AND/OR COLORING OF HUMAN SKIN AND/OR HAIR SOCIETE L'OREAL S.A. (FR) 1999-09-28 US claimed
EP-0903342-B1 4,4-Dihydroxypyrazolin-5-one compounds, procedures for their preparation and their use as cosmetics OREAL (FR) 2003-12-17 EP disclosed
US-5958382-A ARTIFICIAL TANNING AND/OR COLORING OF HUMAN SKIN AND/OR HAIR SOCIETE L'OREAL S.A. (FR) 1999-09-28 US disclosed
EP-0903342-A1 4,4-Dihydroxypyrazolin-5-one compounds, procedures for their preparation and their use as cosmetics L'OREAL (FR) 1999-03-24 EP disclosed