SCHEMBL4527772

SCHEMBL4527772

OCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCBr

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.71
LMNA P02545 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HSD17B10 Q99714 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
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
SCHEMBL4529186 1.00 TSHR (0.71) TSHRLMNAALDH1A1HSD17B10MEN1
SCHEMBL580362 1.00 TSHR (0.71) TSHRLMNAALDH1A1HSD17B10MEN1
SCHEMBL4529371 1.00 TSHR (0.71) TSHRLMNAALDH1A1HSD17B10MEN1
SCHEMBL4533219 1.00 TSHR (0.71) TSHRLMNAALDH1A1HSD17B10MEN1
SCHEMBL4526736 1.00 TSHR (0.71) TSHRLMNAALDH1A1HSD17B10MEN1
SCHEMBL4528370 1.00 TSHR (0.71) TSHRLMNAALDH1A1HSD17B10MEN1
SCHEMBL4527385 1.00 TSHR (0.71) TSHRLMNAALDH1A1HSD17B10MEN1
SCHEMBL52701 1.00 TSHR (0.71) TSHRLMNAALDH1A1HSD17B10MEN1
SCHEMBL3468496 1.00 TSHR (0.71) TSHRLMNAALDH1A1HSD17B10MEN1
SCHEMBL4538390 1.00 TSHR (0.71) TSHRLMNAALDH1A1HSD17B10MEN1

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-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
WO-2007019478-A2 DRUG DELIVERY FROM IMPLANTS USING SELF-ASSEMBLED MONOLAYERS - THERAPEUTIC SAMS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2007-02-15 WO disclosed