SCHEMBL10907300

SCHEMBL10907300

COC(=O)c1ccc(-c2ccc(C(=O)OC)cc2C(F)(F)F)c(C(F)(F)F)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.66
PDK2 Q15119 5/20 0.52
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
CA12 O43570 2/20 0.50
CA7 P43166 2/20 0.50
CA9 Q16790 2/20 0.50
CA14 Q9ULX7 2/20 0.50
P4HB P07237 1/20 0.50
XDH P47989 1/20 0.50
KDM4E B2RXH2 3/20 0.49
ALDH1A1 P00352 3/20 0.49
LMNA P02545 2/20 0.49
HTT P42858 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
PTPRC P08575 1/20 0.47
MAPT P10636 3/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 2/20 0.46
GLA P06280 1/20 0.46

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
SCHEMBL320542 0.88 NOTUM (0.54) NOTUMPDK2P4HB
SCHEMBL3903631 0.88 EGFR (0.57) NOTUMPDK2P4HBMEN1KMT2A
SCHEMBL1997248 0.87 NOTUM (0.73) NOTUMPDK2CA1CA2CA12
SCHEMBL2772008 0.87 NOTUM (0.52) NOTUMPDK2CA1CA2CA12
SCHEMBL536675 0.86 NOTUM (0.51) NOTUMPDK2P4HBKDM4EALDH1A1
SCHEMBL15920972 0.85 KDM4E (0.55) NOTUMPDK2CA1CA2KDM4E
SCHEMBL321308 0.84 NOTUM (0.79) NOTUMPDK2CA1CA2CA12
SCHEMBL10861732 0.84 NOTUM (0.64) NOTUMPDK2CA1CA2CA12
SCHEMBL14012580 0.84 NOTUM (0.64) NOTUMPDK2CA1CA2CA12
SCHEMBL2772563 0.84 NOTUM (0.64) NOTUMPDK2CA1CA2CA12

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-4628125-A POLYESTERS, FILMS, FIBERS POLAROID CORPORATION, PATENT DEPT. (US) 1986-12-09 US disclosed
US-4433132-A MOLECULAT ORIENTATED FILMS AND FIBERS POLAROID CORPORATION (US) 1984-02-21 US disclosed