SCHEMBL9257599

SCHEMBL9257599

C=CC(=O)NC(OCCCC)C(=O)OC(C)C

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.44
HPGD P15428 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
ACACB O00763 2/20 0.38
MAPT P10636 2/20 0.37
RAB9A P51151 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
LMNA P02545 2/20 0.36
ALOX15 P16050 1/20 0.35
ATM Q13315 1/20 0.35
ALDH1A1 P00352 1/20 0.33
TGM2 P21980 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MEN1 O00255 1/20 0.33
FAAH O00519 1/20 0.33
MAPK1 P28482 1/20 0.33
KMT2A Q03164 1/20 0.33
CTSK P43235 1/20 0.32

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
SCHEMBL9000273 0.86 TSHR (0.47) TSHRHPGDZDHHC20ZDHHC2ACACB
SCHEMBL7889401 0.86 TSHR (0.51) TSHRHPGDZDHHC20ZDHHC2ACACB
SCHEMBL11041673 0.84 TSHR (0.42) TSHRHPGDZDHHC20ZDHHC2ACACB
SCHEMBL5685783 0.81 TSHR (0.48) TSHRHPGDZDHHC20ZDHHC2ACACB
SCHEMBL11600754 0.80 TSHR (0.43) TSHRHPGDZDHHC20ZDHHC2ACACB
SCHEMBL9257602 0.80 TSHR (0.41) TSHRHPGDZDHHC20ZDHHC2ACACB
SCHEMBL9640042 0.79 TSHR (0.50) TSHRHPGDZDHHC20ZDHHC2ACACB
SCHEMBL18660323 0.78 TSHR (0.47) TSHRHPGDZDHHC20ZDHHC2ACACB
SCHEMBL6904319 0.78 TSHR (0.47) TSHRHPGDZDHHC20ZDHHC2ACACB
SCHEMBL9316238 0.76 TSHR (0.42) TSHRHPGDZDHHC20ZDHHC2ACACB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5478688-A Liquid developer compositions with charge adjuvants of a copolymer of an alky acrylamidoglycolate alkyl ether and an alkenylester XEROX CORPORATION (US) 1995-12-26 US disclosed