SCHEMBL4646747

SCHEMBL4646747

c1cc(Oc2ccc(CC3CS3)cc2)ccc1CC1CS1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 19/20 0.49
MMP9 P14780 19/20 0.49
MMP14 P50281 14/20 0.49
MMP8 P22894 10/20 0.49
MMP3 P08254 6/20 0.49
MMP7 P09237 4/20 0.49
MMP1 P03956 1/20 0.45
ADAM17 P78536 1/20 0.45

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
SCHEMBL4644559 0.86 MMP2 (0.33) MMP2MMP9MMP14MMP8MMP3
SCHEMBL4992502 0.79 ALDH1A1 (0.36) MMP2MMP9MMP14MMP8MMP3
SCHEMBL10824285 0.76 CAPN1 (0.46) MMP2MMP9MMP14MMP8MMP3
SCHEMBL6916462 0.75 GBA1 (0.43)
SCHEMBL4650286 0.71 TSHR (0.37)
SCHEMBL4647523 0.71 MMP2 (0.43) MMP2MMP9MMP14MMP8MMP3
SCHEMBL1425747 0.70 TDP1 (0.39) MMP2MMP1
SCHEMBL6305833 0.70 TDP1 (0.39) MMP2MMP1
SCHEMBL2786852 0.69 ALDH1A1 (0.43) MMP2MMP9MMP14MMP8MMP3
SCHEMBL15282666 0.69 CYP1A2 (0.48)

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