SCHEMBL4362887

SCHEMBL4362887

CCCCCCCC[S+]([O-])CCCC

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.47
THRB P10828 1/20 0.47
CES2 O00748 3/20 0.38
CES1 P23141 3/20 0.38
DNM1 Q05193 5/20 0.36
ALDH1A1 P00352 3/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HSD17B10 Q99714 1/20 0.36
SLC22A1 O15245 1/20 0.36

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
SCHEMBL27877320 1.00 TSHR (0.47) TSHRTHRBCES2CES1DNM1
SCHEMBL7860236 1.00 TSHR (0.47) TSHRTHRBCES2CES1DNM1
SCHEMBL9818219 0.97 TSHR (0.50) TSHRTHRBCES2CES1DNM1
SCHEMBL4791112 0.97 TSHR (0.50) TSHRTHRBCES2CES1DNM1
SCHEMBL3155716 0.97 TSHR (0.50) TSHRTHRBCES2CES1DNM1
SCHEMBL8587002 0.97 TSHR (0.50) TSHRTHRBCES2CES1DNM1
SCHEMBL14478066 0.97 TSHR (0.50) TSHRTHRBCES2CES1DNM1
SCHEMBL3025854 0.97 TSHR (0.50) TSHRTHRBCES2CES1DNM1
SCHEMBL3160216 0.97 TSHR (0.50) TSHRTHRBCES2CES1DNM1
SCHEMBL296474 0.97 TSHR (0.50) TSHRTHRBCES2CES1DNM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7618555-B2 Ink composition containing red luminous material ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 2009-11-17 US disclosed
US-20080245267-A1 Ink composition containing red luminous material ORIENT CHEMICAL INDUSTRIES, LTD. (JP) 2008-10-09 US disclosed
EP-0527454-B1 Information recording medium having recording layer with organic polymer and dye contained therein HITACHI CHEMICAL CO LTD (JP) 2001-11-07 EP disclosed
US-5648135-A WRITING, ERASING OPTICAL DISKS; NONTOXIC HITACHI CHEMICAL COMPANY, LTD. (JP) 1997-07-15 US disclosed
US-5464673-A Information recording medium having recording layer with organic polymer and dye contained therein HITACHI CHEMICAL CO., LTD. (JP) 1995-11-07 US disclosed
EP-0527454-A1 Information recording medium having recording layer with organic polymer and dye contained therein Hitachi Chemical Co., Ltd. (JP) 1993-02-17 EP disclosed