SCHEMBL5704362

SCHEMBL5704362

CCCCCCCCCCCCCOP(OCCCCCCCCCCCCC)Oc1ccc(C(C)(C)c2ccc(O)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.53
LTA4H P09960 3/20 0.47
ESR1 P03372 7/20 0.43
ESR2 Q92731 4/20 0.43
CYP3A4 P08684 3/20 0.43
SLC6A2 P23975 3/20 0.43
SLC6A4 P31645 3/20 0.43
SLC6A3 Q01959 3/20 0.43
HSD17B10 Q99714 2/20 0.43
TSHR P16473 2/20 0.43
AR P10275 1/20 0.43
HPGD P15428 1/20 0.43
HTR6 P50406 1/20 0.43
ESRRG P62508 1/20 0.43
ALDH1A1 P00352 2/20 0.39
ADRA2A P08913 2/20 0.37
ADORA3 P0DMS8 2/20 0.37
TACR2 P21452 2/20 0.37
LMNA P02545 2/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL5479663 1.00 NR5A1 (0.53) NR5A1LTA4HESR1ESR2CYP3A4
SCHEMBL2885487 1.00 NR5A1 (0.53) NR5A1LTA4HESR1ESR2CYP3A4
SCHEMBL6742945 0.93 NR5A1 (0.40) NR5A1LTA4HHSD17B10TSHRLMNA
SCHEMBL1159982 0.93 NR5A1 (0.40) NR5A1LTA4HHSD17B10TSHRLMNA
Bisphenol A SCHEMBL2031763 0.90 NR5A1 (0.51) NR5A1LTA4HESR1ESR2CYP3A4
SCHEMBL2031764 0.88 NR5A1 (0.51) NR5A1LTA4HESR1ESR2CYP3A4
SCHEMBL2029789 0.88 NR5A1 (0.51) NR5A1LTA4HESR1ESR2CYP3A4
SCHEMBL2034351 0.88 NR5A1 (0.51) NR5A1LTA4HESR1ESR2CYP3A4
SCHEMBL2038524 0.88 NR5A1 (0.51) NR5A1LTA4HESR1ESR2CYP3A4
SCHEMBL30172497 0.88 SMN1; SMN2 (0.44) LTA4HALDH1A1LMNAKDM4ESMN1; SMN2

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
EP-1236758-B1 COLORED MASTER PELLET FOR OPTICAL MOLDINGS AND COLORED OPTICAL DISK SUBSTRATE TEIJIN CHEMICALS LTD (JP) 2006-08-23 EP disclosed
US-6686041-B2 HIGHLY UNIFORM CONCENTRATION; NONSTREAKING; EXCELLENT INFORMATION WRITABILITY AND READABILITY TEIJIN CHEMICALS LTD (JP) 2004-02-03 US disclosed
US-20030124351-A1 HIGHLY UNIFORM CONCENTRATION; NONSTREAKING; EXCELLENT INFORMATION WRITABILITY AND READABILITY TEIJIN CHEMICALS LTD. (JP) 2003-07-03 US disclosed
EP-1236758-A1 COLORED MASTER PELLET FOR OPTICAL MOLDINGS AND COLORED OPTICAL DISK SUBSTRATE Teijin Chemicals, Ltd. (JP) 2002-09-04 EP disclosed