SCHEMBL7513010

SCHEMBL7513010

N#Cc1ccc[c]c1Oc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.41
GAA P10253 2/20 0.41
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
PIN1 Q13526 1/20 0.40
TSHR P16473 2/20 0.38
LTA4H P09960 1/20 0.38
HPGD P15428 3/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
CYP1A2 P05177 3/20 0.34
ALDH1A1 P00352 2/20 0.34
CYP2C19 P33261 2/20 0.34
CYP2C9 P11712 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
RAF1 P04049 2/20 0.34
MAP2K1 Q02750 2/20 0.34
ERBB2 P04626 1/20 0.33
MAPK14 Q16539 1/20 0.33

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
SCHEMBL11409795 0.82 LTA4H (0.38) TSHRLTA4H
Diphenylether SCHEMBL28706414 0.76 LTA4H (0.60) POLBGAAMEN1KMT2ASMN1; SMN2
SCHEMBL2034789 0.76 GAA (0.41) POLBGAASMN1; SMN2TSHRKDM4E
SCHEMBL983525 0.73 TSHR (0.44) GAAKMT2ATSHRLTA4HHPGD
SCHEMBL7803639 0.72 LTA4H (0.43) POLBSMN1; SMN2TSHRLTA4HHPGD
SCHEMBL6036733 0.72 LTA4H (0.42) POLBGAAMEN1KMT2ASMN1; SMN2
SCHEMBL11140990 0.72 LTA4H (0.42) KMT2ATSHRLTA4HHPGDKDM4E
SCHEMBL422932 0.72 MAOA (0.43) GAAMEN1KMT2ASMN1; SMN2TSHR
SCHEMBL4932041 0.72 LTA4H (0.42) TSHRLTA4HHPGDL3MBTL1
SCHEMBL11141243 0.72 LTA4H (0.42) KMT2ATSHRLTA4HKDM4EMAPT

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
US-6399731-B2 SYNTHESIZING POLYMERS USING PHOSPHOROUS-CONTAINING ADDITION-FRAGMENTATION CHAIN TRANSFER AGENTS; MOLECULAR WEIGHT CONTROL THE UNIVERSITY OF AKRON 2002-06-04 US disclosed
US-20020016424-A1 Synthesizing polymers using phosphorous-containing addition-fragmentation chain transfer agents; molecular weight control AKRON, THE UNIVERSITY OF 2002-02-07 US disclosed
WO-2000020465-A1 NOVEL CHAIN TRANSFER AGENTS THE UNIVERSITY OF AKRON (US) 2000-04-13 WO disclosed