SCHEMBL5595897

SCHEMBL5595897

Oc1ccccc1C(CP)c1ccccc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
GABRA1 P14867 1/20 0.50
GABRB2 P47870 1/20 0.50
POLB P06746 2/20 0.44
HPGD P15428 6/20 0.41
LMNA P02545 4/20 0.41
ALDH1A1 P00352 4/20 0.41
MAPT P10636 3/20 0.41
HSD17B10 Q99714 2/20 0.41
ALOX15 P16050 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
KDM4E B2RXH2 2/20 0.41
CA12 O43570 2/20 0.41
CA2 P00918 2/20 0.41
CA4 P22748 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CA14 Q9ULX7 2/20 0.41
NPC1 O15118 1/20 0.41
GMNN O75496 1/20 0.41
EGFR P00533 1/20 0.41

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
SCHEMBL9838282 0.80 GABRA1 (0.54) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL3963673 0.80 GABRA1 (0.54) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL9446023 0.78 GABRA1 (0.52) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL9838259 0.76 TSHR (0.50) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL7108211 0.76 TSHR (0.50) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL4316171 0.76 TSHR (0.50) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL296591 0.76 TSHR (0.68) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL29860994 0.76 TSHR (0.68) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL9623579 0.74 TSHR (0.48) TSHRGABRA1GABRB2POLBHPGD
SCHEMBL9623485 0.74 TSHR (0.48) TSHRGABRA1GABRB2POLBHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7279537-B2 Transition metal complexes and polymerization catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-09 US disclosed
US-20060229195-A1 Transition metal complexes and polymerization catalysts SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-10-12 US disclosed
EP-1557423-A1 TRANSITION METAL COMPLEXES AND POLYMERIZATION CATALYSTS Sumitomo Chemical Company, Limited (JP) 2005-07-27 EP disclosed