SCHEMBL4528477

SCHEMBL4528477

OCCCCCCCCCCCCCCCCCCCCCCCl

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.44
ALDH1A1 P00352 4/20 0.44
LMNA P02545 2/20 0.44
HSD17B10 Q99714 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.39
GPR84 Q9NQS5 1/20 0.38
FFAR1 O14842 1/20 0.38
FFAR4 Q5NUL3 1/20 0.38
MIF P14174 1/20 0.33
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL4532450 1.00 TSHR (0.44) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL4530283 1.00 TSHR (0.44) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL4531940 1.00 TSHR (0.44) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL4534916 1.00 TSHR (0.44) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL4529308 1.00 TSHR (0.44) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL4530049 1.00 TSHR (0.44) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL4525595 1.00 TSHR (0.44) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL4533367 1.00 TSHR (0.44) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL4055586 1.00 TSHR (0.44) TSHRALDH1A1LMNAHSD17B10MEN1
SCHEMBL1940600 1.00

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-20090123516-A1 DRUG DELIVERY FROM IMPLANTS USING SELF-ASSEMBLED MONOLAYERS-THERAPEUTIC SAMS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM 2009-05-14 US disclosed