SCHEMBL27610282

SCHEMBL27610282

[CH2]c1nnnn1-c1ccc(Br)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.46
TSHR P16473 3/20 0.46
LMNA P02545 5/20 0.44
KMT2A Q03164 4/20 0.44
PKM P14618 2/20 0.44
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
TDP1 Q9NUW8 1/20 0.36
MAPT P10636 4/20 0.36
HTT P42858 4/20 0.36
HPGD P15428 3/20 0.36
HSP90AA1 P07900 2/20 0.36
TP53 P04637 2/20 0.36
CACNA1B Q00975 2/20 0.36
APBA1 Q02410 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
NLRP1 Q9C000 1/20 0.36
HSD17B10 Q99714 1/20 0.35
CCR6 P51684 1/20 0.34

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
SCHEMBL8498856 0.80 ALDH1A1 (0.47) ALDH1A1LMNAKMT2APKMMAPT
SCHEMBL27610720 0.79 ALDH1A1 (0.53) ALDH1A1TSHRLMNAKMT2APKM
SCHEMBL8351588 0.78 ALDH1A1 (0.47) ALDH1A1TSHRLMNAKMT2APKM
SCHEMBL5544322 0.76 LMNA (0.54) ALDH1A1TSHRLMNAKMT2APKM
SCHEMBL14119061 0.76 ALDH1A1 (0.46) ALDH1A1TSHRLMNAKMT2APKM
SCHEMBL28144670 0.76 TDP1 (0.47) ALDH1A1TSHRLMNAKMT2APKM
SCHEMBL5541058 0.76 ALDH1A1 (0.55) ALDH1A1TSHRLMNAKMT2APKM
SCHEMBL24185685 0.72 ALDH1A1 (0.55) ALDH1A1TSHRLMNAKMT2APKM
SCHEMBL2010483 0.72 ALDH1A1 (0.70) ALDH1A1TSHRLMNAKMT2APKM
SCHEMBL28433057 0.72 ALDH1A1 (0.49) ALDH1A1TSHRLMNAKMT2APKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102532162-B 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMA CO LTD 2015-05-27 CN disclosed
CN-101255170-A 2,3-dihydroimidazo[2,1-b]oxazole compound OTSUKA PHARMA CO LTD (JP) 2008-09-03 CN disclosed
CN-101172981-A 2,3-dihydroimidazo[2,1-b]oxazole compound OTSUKA PHARMA CO LTD (JP) 2008-05-07 CN disclosed
CN-100366624-C 2, 3-dihydro-6-nitroimidazo [2,1-b ] * azole compounds OTSUKA PHARMA CO LTD (JP) 2008-02-06 CN disclosed
CN-1705670-A 2, 3-dihydro-6-nitroimidazo [2, 1-b ] oxazole compounds OTSUKA PHARMA CO LTD (JP) 2005-12-07 CN disclosed