SCHEMBL4647770

SCHEMBL4647770

c1cc(Cc2ccc(COCC3CS3)cc2)ccc1COCC1CS1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.37
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
TSHR P16473 1/20 0.33
NAAA Q02083 1/20 0.33
TAAR1 Q96RJ0 1/20 0.32
LMNA P02545 1/20 0.32
BCHE P06276 1/20 0.31
ACHE P22303 1/20 0.31
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
MMP14 P50281 1/20 0.30

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
SCHEMBL1402763 0.94 TSHR (0.37) TSHRNAAATAAR1LMNABCHE
SCHEMBL4648468 0.88 NAAA (0.43) TSHRNAAATAAR1LMNA
SCHEMBL2734450 0.84 TSHR (0.54) TSHRNAAATAAR1LMNABCHE
SCHEMBL15794308 0.82 IDO1 (0.47)
SCHEMBL4649028 0.80 HPGD (0.38) ESR1ESR2TSHRNAAA
SCHEMBL4646518 0.80 MMP2 (0.41) LMNAMMP2MMP9MMP8MMP14
SCHEMBL1402494 0.78 TSHR (0.37) TSHRTAAR1LMNABCHEACHE
SCHEMBL1402613 0.76 LTA4H (0.44) LTA4H
SCHEMBL1402838 0.73 CHRNB2 (0.35) TSHRMMP2MMP9MMP8MMP14
SCHEMBL12172323 0.72 MGLL (0.47) LTA4HTSHRTAAR1LMNA

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-20080206668-A1 NEGATIVE RESIST COMPOSITION AND PATTERN FORMING METHOD USING THE SAME FUJIFILM CORPORATION (JP) 2008-08-28 US disclosed
EP-1962139-A1 Negative resist composition and pattern forming method using the same FUJIFILM Corporation (JP) 2008-08-27 EP disclosed