SCHEMBL9344641

SCHEMBL9344641

CCOC(C)Sc1ccc(OC)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
SLC6A4 P31645 1/20 0.39
SERPINH1 P50454 1/20 0.38
CYP1A1 P04798 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP1B1 Q16678 1/20 0.38
APP P05067 1/20 0.38
GAA P10253 1/20 0.37
NR1I2 O75469 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL9348219 0.80 CA1 (0.48) CA12CA1CA2CA7CA9
SCHEMBL9856170 0.77 CA12 (0.44) CA12CA1CA2CA7CA9
SCHEMBL9768873 0.76 APP (0.41) CA12CA1CA2CA7CA9
SCHEMBL26976737 0.76 CA1 (0.52) CA12CA1CA2CA7CA9
SCHEMBL4192430 0.76 CA1 (0.52) CA12CA1CA2CA7CA9
SCHEMBL17400964 0.73 APP (0.44) CA12CA1CA2CA7CA9
SCHEMBL9770242 0.73 ACHE (0.54) CA12CA1CA2CA7CA9
SCHEMBL5160744 0.73 ALDH1A1 (0.56) MEN1ALDH1A1KMT2ACYP1A2GAA
SCHEMBL10913987 0.72 CA1 (0.48) CA12CA1CA2CA7CA9
SCHEMBL9038984 0.72 CA12 (0.42) CA12CA1CA2CA7CA9

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
EP-0357409-B1 Heat-sensitive recording material FUJI PHOTO FILM CO LTD (JP) 1994-07-20 EP disclosed
EP-0357409-A2 Heat-sensitive recording material FUJI PHOTO FILM CO., LTD. (JP) 1990-03-07 EP disclosed