SCHEMBL13638238

SCHEMBL13638238

CC1=CC=C(c2ccco2)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.39
KDM4E B2RXH2 7/20 0.39
HPGD P15428 6/20 0.39
HSD17B10 Q99714 5/20 0.39
POLB P06746 4/20 0.39
MAPT P10636 4/20 0.39
KMT2A Q03164 4/20 0.39
ALOX15 P16050 3/20 0.39
MEN1 O00255 3/20 0.39
PKM P14618 2/20 0.39
CASP1 P29466 2/20 0.39
PTPN7 P35236 2/20 0.39
RECQL P46063 2/20 0.39
BLM P54132 2/20 0.39
CASP7 P55210 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
USP2 O75604 1/20 0.39

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
SCHEMBL7178077 0.72 ALDH1A1 (0.39) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL21533809 0.69 KDM4E (0.40) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL17147182 0.69 TDP1 (0.40) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL28335842 0.68 POLB (0.35) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL7174595 0.67 ALDH1A1 (0.38) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL1799678 0.67 ALDH1A1 (0.63) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL26545868 0.66 ALDH1A1 (0.33) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL8273942 0.64 ALDH1A1 (0.48) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL15871996 0.64 TAAR1 (0.54) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL1176634 0.63 ALDH1A1 (0.38) ALDH1A1KDM4EHPGDHSD17B10POLB

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
US-7619030-B2 Automobile part of polypropylene resin composition MITSUI CHEMICALS, INC. (JP) 2009-11-17 US disclosed
US-7449533-B2 Metallocene compound, process for preparing metallocene compound, olefin polymerization catalyst, process for preparing polyolefin, and polyolefin MITSUI CHEMICALS, INC. (JP) 2008-11-11 US disclosed