SCHEMBL7901728

SCHEMBL7901728

C=C(OCc1ccc(CO)cc1)c1cccc(CO)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.46
PRSS2 P07478 1/20 0.46
PRSS3 P35030 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.43
TSHR P16473 2/20 0.43
RAB9A P51151 3/20 0.42
NPC1 O15118 2/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42
XBP1 P17861 1/20 0.42
HTT P42858 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PRKCA P17252 1/20 0.40
PRKCD Q05655 1/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A3 Q01959 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ENPP2 Q13822 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.35

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
SCHEMBL7900447 0.93 KMT2A (0.47) PRSS1PRSS2PRSS3SMN1; SMN2TSHR
SCHEMBL7898715 0.84 KMT2A (0.47) SMN1; SMN2TSHRRAB9ANPC1MAPT
SCHEMBL7901731 0.83 TSHR (0.50) SMN1; SMN2TSHRMAPTSLC6A2SLC6A3
SCHEMBL7892902 0.82 KMT2A (0.42) PRSS1PRSS2PRSS3SMN1; SMN2TSHR
SCHEMBL7904061 0.79 TDP1 (0.50) SMN1; SMN2RAB9ANPC1TP53MAPT
SCHEMBL7900073 0.78 ABAT (0.41) PRSS1PRSS2PRSS3SMN1; SMN2TSHR
SCHEMBL5367985 0.76 TDP1 (0.59) SMN1; SMN2TSHRRAB9ANPC1MAPT
SCHEMBL7892900 0.75 ALDH1A1 (0.65) SMN1; SMN2RAB9ANPC1TP53MAPT
SCHEMBL7892810 0.74 IRAK4 (0.35) SMN1; SMN2TSHRRAB9ANPC1TP53
SCHEMBL15012759 0.73 TDP1 (0.71) SMN1; SMN2TSHRRAB9ANPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6197905-B1 VINYL ETHER CHAIN TRANSFER AGENT TERMINATES THE GROWTH OF THE POLYMER CHAIN BY ADDITION TO THE PROPAGATING POLYMER RADICAL FOLLOWED BY EXPULSION OF A RADICAL WHICH THEN INITIATES ANOTHER POLYMER CHAIN COMMONWEALTH SCIENTIFIC & INDUSTRIAL RESARCH ORGANIZATION (AU) 2001-03-06 US disclosed
EP-0333758-B1 CONTROL OF MOLECULAR WEIGHT AND END GROUP FUNCTIONALITY OF POLYMERS COMMW SCIENT IND RES ORG (AU) 1995-11-02 EP disclosed
US-5385996-A Control of molecular weight and end-group functionality of polymers COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 1995-01-31 US disclosed
EP-0333758-A4 CONTROL OF MOLECULAR WEIGHT AND END GROUP FUNCTIONALITY OF POLYMERS. COMMW SCIENT IND RES ORG (AU) 1990-05-14 EP disclosed
EP-0333758-A1 CONTROL OF MOLECULAR WEIGHT AND END GROUP FUNCTIONALITY OF POLYMERS. COMMW SCIENT IND RES ORG (AU) 1989-09-27 EP disclosed
WO-1988004304-A1 CONTROL OF MOLECULAR WEIGHT AND END GROUP FUNCTIONALITY OF POLYMERS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH OR (AU) 1988-06-16 WO disclosed