SCHEMBL4458146

SCHEMBL4458146

CCCc1ccccc1P(=O)(OC1CC1)OC1CC1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 2/20 0.35
ADRA2B P18089 2/20 0.35
ADRA2C P18825 2/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
HCRTR2 O43614 1/20 0.32
PPARD Q03181 1/20 0.32
HSD17B10 Q99714 2/20 0.31
TSHR P16473 1/20 0.31
HTR1A P08908 1/20 0.31
NISCH Q9Y2I1 1/20 0.31
NPSR1 Q6W5P4 1/20 0.30
ELANE P08246 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HIF1A Q16665 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
SCHEMBL4448582 0.93 KMT2A (0.36) ADRA2AADRA2BADRA2CMEN1KMT2A
SCHEMBL4456055 0.91 LIPG (0.34) TSHRHIF1A
SCHEMBL4450443 0.89 CTSB (0.36) MEN1KMT2AHCRTR2HSD17B10TSHR
SCHEMBL4448724 0.87 MEN1 (0.31) ADRA2AADRA2BADRA2CMEN1KMT2A
SCHEMBL4454572 0.84 CNR1 (0.39) MEN1KMT2AHSD17B10TSHRNPSR1
SCHEMBL4456122 0.81 TSHR (0.39) MEN1KMT2AHSD17B10TSHRNPSR1
SCHEMBL4458061 0.80 MEN1 (0.36) MEN1KMT2APPARDNPSR1
SCHEMBL4458096 0.80 MEN1 (0.50) MEN1KMT2AHSD17B10NPSR1ALDH1A1
SCHEMBL4458037 0.79 PTGS2 (0.32) MEN1KMT2A
SCHEMBL4446442 0.78 PPARD (0.35) MEN1KMT2APPARDTSHRELANE

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-7612148-B2 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2009-11-03 US disclosed
US-20080146733-A1 Hydrogenation catalyst composition and method for hydrogenation of conjugated diene polymer TSRC CORPORATION (TW) 2008-06-19 US disclosed