SCHEMBL1673300

SCHEMBL1673300

C=CC(C)(C(=O)OC)C(C)CC

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 1/20 0.34
TAS1R1 Q7RTX1 1/20 0.34
MMP1 P03956 1/20 0.32
MMP2 P08253 1/20 0.32
MMP3 P08254 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
DGAT1 O75907 1/20 0.31
MMP8 P22894 1/20 0.31

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
SCHEMBL8047930 0.75 MAPT (0.35) TAS1R3TAS1R1MMP1MMP2MMP3
SCHEMBL14156214 0.75 MAPT (0.35) TAS1R3TAS1R1MMP1MMP2MMP3
SCHEMBL8212493 0.74 TAS1R3 (0.38) TAS1R3TAS1R1MMP1MMP2MMP3
SCHEMBL27163495 0.72 DGAT1 (0.35) DGAT1MMP8
SCHEMBL15233855 0.71 TAS1R3 (0.35) TAS1R3TAS1R1MMP1MMP2MMP3
SCHEMBL11861641 0.71 TAS1R3 (0.36) TAS1R3TAS1R1MMP1MMP2MMP3
SCHEMBL12504319 0.71 CA1 (0.38) TAS1R3TAS1R1MMP1MMP2MMP3
SCHEMBL28709492 0.69 LMNA (0.33) DGAT1
SCHEMBL14156407 0.69 TAS1R3 (0.33) TAS1R3TAS1R1CA1CA2DGAT1
SCHEMBL8065040 0.69 TAS1R3 (0.33) TAS1R3TAS1R1CA1CA2DGAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012046826-A1 BLACK POLYMERIZABLE COMPOSITION AND METHOD FOR PRODUCING A BLACK LAYER FUJIFILM CORPORATION (JP) 2012-04-12 WO disclosed