SCHEMBL9683695

SCHEMBL9683695

COC(=O)CCNC(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.57
CA12 O43570 5/20 0.52
CA14 Q9ULX7 5/20 0.52
EPHX2 P34913 1/20 0.47
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 3/20 0.41
KDM4E B2RXH2 1/20 0.41
RECQL P46063 1/20 0.41
CA7 P43166 3/20 0.41
CA9 Q16790 3/20 0.41
HSD17B10 Q99714 2/20 0.40
MAPT P10636 2/20 0.40
CA2 P00918 1/20 0.40
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL9683541 0.84 TSHR (0.58) TSHREPHX2LMNARECQLALDH1A1
SCHEMBL19239219 0.82 TSHR (0.56) TSHREPHX2LMNARECQLALDH1A1
SCHEMBL29004441 0.81 TSHR (0.52) TSHRCA12CA14EPHX2KMT2A
SCHEMBL7088568 0.81 GAA (0.54) KMT2AMGAMGAASIMGAM2
SCHEMBL13813999 0.80 TSHR (0.57) TSHRCA12CA14EPHX2KMT2A
SCHEMBL3407201 0.80 TSHR (0.57) TSHRCA12CA14EPHX2KMT2A
SCHEMBL14403186 0.79 TSHR (0.47) TSHRCA12CA14EPHX2KMT2A
SCHEMBL18752931 0.78 TSHR (0.55) TSHRCA12CA14EPHX2KMT2A
SCHEMBL10057015 0.78 TSHR (0.55) TSHRCA12CA14EPHX2KMT2A
SCHEMBL16246880 0.78 TSHR (0.55) TSHRCA12CA14EPHX2KMT2A

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-20080058495-A1 Polyester polymer and copolymer compositions containing titanium and yellow colorants EASTMAN CHEMICAL COMPANY 2008-03-06 US disclosed
EP-0509795-A2 Carbamates of rapamycin AMERICAN HOME PRODUCTS CORPORATION (US) 1992-10-21 EP disclosed
US-5118678-A Antibody inhibitors, antiinflammatory agents, fungicides, antitumor agents AMERICAN HOME PRODUCTS CORPORATION (US) 1992-06-02 US disclosed