SCHEMBL4454749

SCHEMBL4454749

Cc1ccccc1OP(=O)(O)C(=O)C=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.44
SRC P12931 1/20 0.41
KDM4E B2RXH2 2/20 0.40
NOTUM Q6P988 1/20 0.39
ALDH1A1 P00352 3/20 0.38
MAPT P10636 1/20 0.38
USP2 O75604 1/20 0.38
HPGD P15428 1/20 0.38
PDE3A Q14432 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
BCHE P06276 1/20 0.37
POLB P06746 1/20 0.37
CYP1A2 P05177 1/20 0.36
TSHR P16473 1/20 0.36
TP53 P04637 1/20 0.36
HTT P42858 1/20 0.36

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
SCHEMBL4451647 0.81 L3MBTL1 (0.41) NPSR1SRCKDM4EALDH1A1MAPT
SCHEMBL4448608 0.77 THRA (0.40) SRC
SCHEMBL778117 0.77 HPGD (0.45) NPSR1KDM4ENOTUMALDH1A1MAPT
SCHEMBL1100136 0.76 INPPL1 (0.57) NPSR1SRCKDM4ENOTUMALDH1A1
SCHEMBL497602 0.76 KDM4E (0.47) NPSR1SRCKDM4ENOTUMALDH1A1
Formic Acid SCHEMBL27529024 0.75 NPSR1 (0.45) NPSR1SRCKDM4ENOTUMALDH1A1
SCHEMBL4459677 0.75 SRC (0.55) SRCKDM4EALDH1A1
Fluoride SCHEMBL31047191 0.74 KDM4E (0.46) NPSR1SRCKDM4ENOTUMALDH1A1
SCHEMBL29199066 0.74 INPPL1 (0.55) NPSR1SRCKDM4ENOTUMALDH1A1
SCHEMBL776643 0.74 KDM4E (0.46) NPSR1SRCKDM4ENOTUMALDH1A1

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