SCHEMBL8600151

SCHEMBL8600151

CCCc1ccc(CCC)c2c1OBO2

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.33
CTRC Q99895 1/20 0.33
GPR84 Q9NQS5 1/20 0.33
MTNR1A P48039 1/20 0.33
TYR P14679 2/20 0.32
CA12 O43570 1/20 0.32
ALOX5 P09917 2/20 0.31
HTT P42858 2/20 0.31
LPL P06858 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPT P10636 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 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
SCHEMBL8557289 0.82 ALDH1A1 (0.41) ALOX5CYP3A4
SCHEMBL8519403 0.80 CTRC (0.37) CTRC
SCHEMBL8519249 0.80 MTNR1A (0.37) GPR84MTNR1AALOX5LIPG
SCHEMBL8520138 0.78
SCHEMBL8600153 0.71 PRKCI (0.33) PRKCIGPR84CA12
SCHEMBL8601604 0.71 ALDH1A1 (0.45) CYP3A4
SCHEMBL11349053 0.67 PRKCI (0.46) PRKCITYRALOX5HTTMEN1
SCHEMBL2438857 0.67 CTRC (0.34) PRKCICTRC
SCHEMBL2015262 0.67 NPC1 (0.31) PRKCIHTTNPC1RAB9ASMN1; SMN2
SCHEMBL1711830 0.66 KDM4E (0.39) PRKCITYRCA12ALOX5HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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