SCHEMBL8319953

SCHEMBL8319953

CO[Hf](OC)(OCc1ccccc1)OCc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.48
IDO1 P14902 1/20 0.44
AGXT P21549 1/20 0.43
ALDH1A1 P00352 3/20 0.42
MAOB P27338 2/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
MAPT P10636 2/20 0.41
MAPK1 P28482 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
LTA4H P09960 1/20 0.39
TP53 P04637 1/20 0.39
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA9 Q16790 2/20 0.38
SLC6A2 P23975 2/20 0.38
SLC6A3 Q01959 2/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
PTGS1 P23219 1/20 0.38
CYP2C19 P33261 1/20 0.38

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
SCHEMBL7597803 0.85 TSHR (0.57) TSHRIDO1AGXTALDH1A1MAOB
SCHEMBL794 0.72
SCHEMBL7590821 0.71 TSHR (0.52) TSHRIDO1AGXTALDH1A1MAOB
SCHEMBL7596479 0.71 TSHR (0.52) TSHRIDO1AGXTALDH1A1MAOB
SCHEMBL7593941 0.71 TSHR (0.52) TSHRIDO1AGXTALDH1A1MAOB
SCHEMBL7589658 0.71 TSHR (0.52) TSHRIDO1AGXTALDH1A1MAOB
SCHEMBL7596671 0.71 TSHR (0.52) TSHRIDO1AGXTALDH1A1MAOB
SCHEMBL7596736 0.71 TSHR (0.52) TSHRIDO1AGXTALDH1A1MAOB
SCHEMBL7596165 0.71 TSHR (0.52) TSHRIDO1AGXTALDH1A1MAOB
SCHEMBL7592989 0.71 TSHR (0.52) TSHRIDO1AGXTALDH1A1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6111040-A Process for the production of olefinic polymers NIPPON MITSUBISHI OIL CORPORATION (JP) 2000-08-29 US disclosed
EP-0745616-B1 Catalyst composition and process for the production of olefinic polymers NIPPON OIL CO LTD (JP) 1999-04-07 EP disclosed
US-5750454-A Catalyst composition and process for the production of olefinic polymers NIPPON OIL CO., LTD. (JP) 1998-05-12 US disclosed
EP-0748823-A1 Catalyst composition and process for the production of olefinic polymers NIPPON OIL CO. LTD. (JP) 1996-12-18 EP disclosed
EP-0745616-A1 Catalyst composition and process for the production of olefinic polymers NIPPON OIL CO. LTD. (JP) 1996-12-04 EP disclosed