SCHEMBL9350853

SCHEMBL9350853

CCCCNC(=S)SC(N)=S

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
EPHX1 P07099 4/20 0.38
ACHE P22303 3/20 0.35
MMP2 P08253 1/20 0.35
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HTT P42858 3/20 0.34
MAPT P10636 2/20 0.34
GAA P10253 1/20 0.34
ALOX12 P18054 1/20 0.34
CRHBP P24387 1/20 0.34

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
SCHEMBL11706920 0.92 EPHX1 (0.45) EPHX1
SCHEMBL15463389 0.92 EPHX1 (0.45) EPHX1
SCHEMBL29619546 0.92 EPHX1 (0.45) EPHX1
SCHEMBL9351011 0.87 KDM4A (0.36) KMT2AEPHX1MMP2MAPTGAA
SCHEMBL3080935 0.84 NOS3 (0.41) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL3654082 0.82 KDM4A (0.46) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL78835 0.80 EPHX1 (0.48) EPHX1ALDH1A1
SCHEMBL8935570 0.78 EPHX1 (0.52) EPHX1ALDH1A1
SCHEMBL9350835 0.78
SCHEMBL3071595 0.78 MEN1 (0.37) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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
EP-0504320-B1 METHOD FOR PREPARING STERICALLY HINDERED ARYL PHOSPHITES UNIROYAL CHEM CO INC (US) 1994-09-21 EP disclosed
EP-0583369-A1 TIRE TREAD COMPOSITIONS. UNIROYAL CHEM CO INC (US) 1994-02-23 EP disclosed
US-5254709-A Catalytic reaction of phosphorus trihalide with a phenolic compound UNIROYAL CHEMICAL COMPANY, INC. (US) 1993-10-19 US disclosed
WO-1992020737-A2 TIRE TREAD COMPOSITIONS UNIROYAL CHEMICAL COMPANY, INC. (US) 1992-11-26 WO disclosed
EP-0504320-A1 METHOD FOR PREPARING STERICALLY HINDERED ARYL PHOSPHITES. UNIROYAL CHEM CO INC (US) 1992-09-23 EP disclosed
WO-1991009040-A1 METHOD FOR PREPARING STERICALLY HINDERED ARYL PHOSPHITES UNIROYAL CHEMICAL COMPANY, INC. (US) 1991-06-27 WO disclosed