SCHEMBL6131317

SCHEMBL6131317

C=C(C=S)C(=O)OCCCC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.52
HPGD P15428 1/20 0.50
ATM Q13315 1/20 0.48
ALDH1A1 P00352 1/20 0.47
HCAR2 Q8TDS4 3/20 0.43
NAAA Q02083 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
NPSR1 Q6W5P4 2/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
RAD52 P43351 1/20 0.37
EPHX1 P07099 1/20 0.36
THRB P10828 1/20 0.36
LMNA P02545 1/20 0.36
ESR1 P03372 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPK1 P28482 1/20 0.36
CYP2C19 P33261 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
SCHEMBL4829182 0.88 TSHR (0.41) TSHRHPGDATMALDH1A1HCAR2
SCHEMBL4434360 0.82 TSHR (0.62) TSHRHPGDATMALDH1A1HCAR2
SCHEMBL18280666 0.80 GAA (0.40) TSHRHPGDALDH1A1L3MBTL1MAPT
SCHEMBL22471930 0.79 ATM (0.52) TSHRHPGDATMALDH1A1HCAR2
SCHEMBL1078981 0.78 HCAR2 (0.62) TSHRHPGDATMALDH1A1HCAR2
SCHEMBL7798178 0.78 TSHR (0.49) TSHRHPGDATMALDH1A1HCAR2
SCHEMBL9113783 0.78 TSHR (0.45) TSHRTHRB
SCHEMBL5871854 0.77 TSHR (0.61) TSHRHPGDATMALDH1A1HCAR2
SCHEMBL13518226 0.77 TSHR (0.61) TSHRHPGDATMALDH1A1HCAR2
SCHEMBL7774844 0.77 TSHR (0.61) TSHRHPGDATMALDH1A1HCAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1605025-A1 Ink stock solution for ink jet recording, method for manufacturing the same and ink for ink jet recording Fuji Photo Film Co., Ltd. (JP) 2005-12-14 EP disclosed
US-20050270349-A1 Ink stock solution for ink jet recording, method for manufacturing the same and ink for ink jet recording FUJI PHOTO FILM CO., LTD. 2005-12-08 US disclosed
US-20050004318-A1 Curable composition OHSHIRO NOBUAKI (JP) 2005-01-06 US disclosed
EP-1452550-A1 CURABLE COMPOSITION KANEKA CORPORATION (JP) 2004-09-01 EP disclosed
EP-0273710-B2 Resin having high refractive index, process for producing said resin and optical materials composed of said resin NIPPON CATALYTIC CHEM IND (JP) 1996-10-16 EP disclosed
US-4931521-A Optical materials composed of resin from thioacrylat esters NIPPON SHOKUBAI KAGAKU KOGYO CO., LTD. (JP) 1990-06-05 US disclosed
EP-0273710-A2 Resin having high refractive index, process for producing said resin and optical materials composed of said resin Nippon Shokubai Kagaku Kogyo Co., Ltd (JP) 1988-07-06 EP disclosed