SCHEMBL9856492

SCHEMBL9856492

CCOC(=O)NC(C)Oc1ccc(O)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.47
MAPK1 P28482 2/20 0.47
MIF P14174 1/20 0.46
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA7 P43166 2/20 0.45
CA9 Q16790 2/20 0.45
CA14 Q9ULX7 2/20 0.45
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
LMNA P02545 3/20 0.43
HTT P42858 1/20 0.43
ACACB O00763 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KMT2A Q03164 2/20 0.41
GAA P10253 1/20 0.41
TSHR P16473 2/20 0.40
NPC1 O15118 1/20 0.40
HPGD P15428 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
SCHEMBL11849307 0.83 PCNA (0.42) MIFCA12CA1CA2CA7
SCHEMBL8155301 0.81 SMN1; SMN2 (0.54) SMN1; SMN2MAPK1LMNAHTTACACB
SCHEMBL9856510 0.80 SMN1; SMN2 (0.41) SMN1; SMN2MAPK1LMNAHTTACACB
SCHEMBL9621303 0.77 LMNA (0.66) SMN1; SMN2MAPK1CA12CA1CA2
SCHEMBL2481397 0.77 LMNA (0.66) SMN1; SMN2MAPK1CA12CA1CA2
SCHEMBL5789381 0.77 LMNA (0.66) SMN1; SMN2MAPK1CA12CA1CA2
SCHEMBL9836225 0.75 CA12 (0.53) SMN1; SMN2MAPK1MIFCA12CA1
SCHEMBL3404315 0.75 CA12 (0.52) SMN1; SMN2MAPK1MIFCA12CA1
SCHEMBL28081933 0.75 TSHR (0.52) SMN1; SMN2MAPK1CA12CA1CA2
SCHEMBL11428710 0.74 MAPK1 (0.44) SMN1; SMN2MAPK1MIFCA12CA1

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-5037991-A Insecticides SANDOZ LTD. (CH) 1991-08-06 US disclosed
US-4968829-A ANTHELMINTICS, PARASITICIDES, NEMATOCIDES SANDOZ LTD. (CH) 1990-11-06 US disclosed