SCHEMBL8548495

SCHEMBL8548495

CC(C)(C)N(C(=O)O)c1ccccc1-c1oc2ccc(CBr)cc2c1Cl

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.35
KMT2A Q03164 6/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
ALOX5 P09917 2/20 0.33
USP2 O75604 1/20 0.33
TSHR P16473 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
AGTR1 P30556 1/20 0.33
POLB P06746 2/20 0.33
KDM4E B2RXH2 2/20 0.32
MAPT P10636 2/20 0.32
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
HPGD P15428 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL8550091 0.89 MEN1 (0.38) MEN1KMT2AALDH1A1LMNAAGTR1
SCHEMBL8548832 0.86 KDM4E (0.44) MEN1KMT2AALDH1A1LMNAALOX5
SCHEMBL8548499 0.84 MEN1 (0.36) MEN1KMT2AALDH1A1LMNAUSP2
SCHEMBL8550098 0.81 MEN1 (0.39) MEN1KMT2AALDH1A1LMNAMAPT
SCHEMBL9318339 0.77 ALOX5 (0.38) MEN1KMT2AALDH1A1LMNAALOX5
SCHEMBL8549279 0.75 KDM4E (0.43) MEN1KMT2AALDH1A1LMNAALOX5
SCHEMBL9320103 0.75 SLC6A3 (0.43) KMT2AALDH1A1LMNAALOX5KDM4E
SCHEMBL9571330 0.74 CYP4F2 (0.53) MEN1KMT2AALDH1A1ALOX5TSHR
SCHEMBL8548840 0.70 KDM4E (0.35) MEN1KMT2AALDH1A1LMNAUSP2
SCHEMBL9616424 0.69 AGTR1 (0.43) AGTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0514198-B1 1H-Imidazol-1-yl-methyl benzofuran derivatives with the imidazolyl moiety being substituted by a cycloalkyl group GLAXO GROUP LTD (GB) 1998-08-05 EP disclosed
US-5498722-A HYPOTENSIVES GLAXO GROUP (GB) 1996-03-12 US disclosed
US-5332831-A Angiotensin antagonist GLAXO GROUP LIMITED (GB) 1994-07-26 US disclosed
EP-0514198-A1 1H-Imidazol-1-yl-methyl benzofuran derivatives with the imidazolyl moiety being substituted by a cycloalkyl group GLAXO GROUP LIMITED (GB) 1992-11-19 EP disclosed