SCHEMBL21101532

SCHEMBL21101532

O=P(O)(O)C#CC1CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 5/20 0.34
CA12 O43570 4/20 0.34
CA1 P00915 4/20 0.34
CA2 P00918 4/20 0.34
CA9 Q16790 4/20 0.34
MMP1 P03956 3/20 0.34
MMP8 P22894 2/20 0.34
MMP3 P08254 2/20 0.34
FDPS P14324 1/20 0.34
MMP9 P14780 1/20 0.31
FFAR1 O14842 1/20 0.31
FFAR4 Q5NUL3 1/20 0.31
METAP1 P53582 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
SCHEMBL21101535 0.76
SCHEMBL2106124 0.69 KCNH2 (0.39) FFAR1FFAR4
SCHEMBL3757679 0.66
SCHEMBL30726857 0.66 KCNH2 (0.34) FFAR1FFAR4
SCHEMBL26080893 0.65 KCNH2 (0.31)
SCHEMBL31069806 0.63 FFAR1 (0.39) FFAR1FFAR4
SCHEMBL420248 0.63 FFAR1 (0.39) FFAR1FFAR4
SCHEMBL5029009 0.62 CA2 (0.39) MMP2CA2FDPS
Biphenyl SCHEMBL8370297 0.62 ALDH1A1 (0.53) MMP2CA12CA1CA2CA9
SCHEMBL31266627 0.62 CA12 (0.31) CA12CA1FFAR1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200035419-A1 PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL, METHOD FOR MANUFACTURING PHOTOELECTRIC CONVERSION ELEMENT, AND PHOTOSENSITIVE-LAYER-FORMING COMPOSITION FUJIFILM CORPORATION (JP) 2020-01-30 US disclosed
EP-3509117-A1 PHOTOELECTRIC CONVERSION ELEMENT, SOLAR BATTERY, METHOD FOR MANUFACTURING PHOTOELECTRIC CONVERSION ELEMENT, AND SURFACE TREATMENT AGENT FOR PEROVSKITE-TYPE CRYSTAL FILM FUJIFILM Corporation (JP) 2019-07-10 EP disclosed
US-20190189362-A1 PHOTOELECTRIC CONVERSION ELEMENT, SOLAR CELL, METHOD FOR MANUFACTURING PHOTOELECTRIC CONVERSION ELEMENT, AND SURFACE TREATING AGENT FOR PEROVSKITE-TYPE CRYSTAL FILM FUJIFILM CORPORATION (JP) 2019-06-20 US disclosed