SCHEMBL4030087

SCHEMBL4030087

CCO[SiH](C)Nc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.41
GAA P10253 3/20 0.38
TSHR P16473 3/20 0.36
HPGD P15428 1/20 0.34
MAPT P10636 5/20 0.33
TDP1 Q9NUW8 4/20 0.33
ALDH1A1 P00352 4/20 0.33
HSD17B10 Q99714 3/20 0.33
MAPK1 P28482 2/20 0.33
CTSD P07339 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
LTA4H P09960 1/20 0.32
ALOX15 P16050 1/20 0.32
ALOX12 P18054 1/20 0.32
PTGS1 P23219 1/20 0.32
SLC6A2 P23975 1/20 0.32
PTGS2 P35354 1/20 0.32
HTR2B P41595 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL3891707 0.81 NPSR1 (0.42) NPSR1GAATSHRHPGDMAPT
SCHEMBL5598837 0.73 TSHR (0.56) NPSR1GAATSHRHPGDMAPT
SCHEMBL10359188 0.71 TSHR (0.40) NPSR1GAATSHRHPGDMAPT
SCHEMBL304793 0.71 TSHR (0.58) NPSR1GAATSHRHPGDMAPT
SCHEMBL1854492 0.69 MAPT (0.40) NPSR1GAATSHRHPGDMAPT
SCHEMBL1345309 0.69 TSHR (0.48) NPSR1TSHRHPGDMAPTTDP1
SCHEMBL16794750 0.69 TSHR (0.42) NPSR1GAATSHRHPGDMAPT
SCHEMBL704521 0.69 RELA (0.38) NPSR1TSHRALDH1A1LTA4HL3MBTL1
Biphenyl SCHEMBL28295625 0.67 ALDH1A1 (0.43) HPGDMAPTALDH1A1MAPK1SMN1; SMN2
SCHEMBL774108 0.67 MAPT (0.47) NPSR1GAAMAPTALDH1A1LMNA

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-20090169593-A1 METHOD OF USING AND PRODUCING TROPOELASTIN AND TROPOELASTIN BIOMATERIALS BIOMEDICAL RESEARCH SERVICES, INC. (US) 2009-07-02 US disclosed