SCHEMBL7928633

SCHEMBL7928633

CC=[Zr](OC(=O)c1ccccc1)(OC(=O)c1ccccc1)(C1=C(C)C(C)=C(C)C1(C)C)C1=C(C)C(C)=C(C)C1(C)C

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.38
KMT2A Q03164 5/20 0.37
NPSR1 Q6W5P4 3/20 0.37
GAA P10253 1/20 0.37
LMNA P02545 2/20 0.36
F2 P00734 1/20 0.36
TP53 P04637 1/20 0.35
KDM4E B2RXH2 1/20 0.34
TDP1 Q9NUW8 2/20 0.33
ALDH1A1 P00352 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
MEN1 O00255 1/20 0.33
MAPK1 P28482 1/20 0.33
MAPT P10636 1/20 0.32
PLA2G7 Q13093 2/20 0.32
PDCD1 Q15116 1/20 0.32
CD274 Q9NZQ7 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
SCHEMBL8724522 0.70 KMT2A (0.42) TSHRKMT2ANPSR1GAALMNA
Hydrochloric Acid SCHEMBL7931043 0.69 KMT2A (0.41) TSHRKMT2ANPSR1GAALMNA
SCHEMBL7930719 0.69 TSHR (0.37) TSHRKMT2ANPSR1GAALMNA
SCHEMBL7925137 0.68 TSHR (0.42) TSHRKMT2ANPSR1GAALMNA
SCHEMBL7925424 0.68 TSHR (0.42) TSHRKMT2ANPSR1GAALMNA
SCHEMBL7924660 0.68 TSHR (0.42) TSHRKMT2ANPSR1GAALMNA
SCHEMBL7927585 0.67 TSHR (0.41) TSHRKMT2ANPSR1GAALMNA
SCHEMBL7927401 0.67 TSHR (0.41) TSHRKMT2ANPSR1GAALMNA
SCHEMBL7928291 0.67 TSHR (0.41) TSHRKMT2ANPSR1GAALMNA
Hydrochloric Acid SCHEMBL7919599 0.66 TSHR (0.40) TSHRKMT2ANPSR1GAALMNA

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
EP-0867454-B1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN CO (JP) 2001-03-21 EP disclosed
US-6075102-A Polymerization catalyst and process for producing polymers IDEMITSU KOSAN CO., LTD. (JP) 2000-06-13 US disclosed
EP-0867454-A1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN COMPANY LIMITED (JP) 1998-09-30 EP disclosed