SCHEMBL8519249

SCHEMBL8519249

CCCc1cccc2c1OBO2

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 6/20 0.37
GPR84 Q9NQS5 1/20 0.32
DAO P14920 1/20 0.31
ELANE P08246 1/20 0.31
ALOX5 P09917 1/20 0.30
PTGS2 P35354 1/20 0.30
LIPG Q9Y5X9 1/20 0.30
ADRA2A P08913 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30

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
SCHEMBL8520071 0.85 GABRA1 (0.40) MTNR1AELANE
SCHEMBL8600151 0.80 PRKCI (0.33) MTNR1AGPR84ALOX5LIPG
SCHEMBL8520138 0.76
SCHEMBL138232 0.76 AHR (0.38) MTNR1ADAOELANE
SCHEMBL8557289 0.76 ALDH1A1 (0.41) ALOX5
SCHEMBL8601604 0.74 ALDH1A1 (0.45)
SCHEMBL1695785 0.73 ALDH1A1 (0.41) MTNR1ADAOELANE
SCHEMBL19772837 0.72 MTNR1A (0.45) MTNR1A
SCHEMBL8519251 0.70 MTNR1A (0.34) MTNR1ADAOELANE
SCHEMBL10244178 0.70 MTNR1A (0.59) MTNR1A

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-0679662-B1 Catalyst component for the polymerization of olefins NIPPON OIL CO LTD (JP) 1999-07-14 EP disclosed
US-5728641-A Catalyst component for the polymerization of olefins NIPPON OIL COMPANY, LIMITED (JP) 1998-03-17 US disclosed
EP-0679662-A1 Catalyst component for the polymerization of olefins NIPPON OIL CO. LTD. (JP) 1995-11-02 EP disclosed