SCHEMBL5873447

SCHEMBL5873447

Cc1c(C(=O)O)ccc2oc(-c3c(Cl)cccc3Cl)nc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 2/20 0.47
TYK2 P29597 2/20 0.47
ITGB1 P05556 2/20 0.40
ITGA4 P13612 2/20 0.40
ITGB7 P26010 2/20 0.40
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 2/20 0.39
USP2 O75604 1/20 0.39
MT-CO2 P00403 1/20 0.39
TTR P02766 1/20 0.39
PLA2G1B P04054 1/20 0.39
CYP1A2 P05177 1/20 0.39
PGR P06401 1/20 0.39
CYP3A4 P08684 1/20 0.39
HTR1A P08908 1/20 0.39
ADRA2A P08913 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
AR P10275 1/20 0.39

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
SCHEMBL440239 0.83 JAK2 (0.51) JAK2TYK2ITGB1ITGA4ITGB7
SCHEMBL6614013 0.73 JAK2 (0.39) JAK2TYK2MAPTMEN1KMT2A
SCHEMBL2955256 0.71 MYC (0.49) MEN1KMT2ALMNACYP1A2CYP3A4
SCHEMBL444748 0.71 HDAC6 (0.55) ITGB1ITGA4ITGB7MAPTTTR
SCHEMBL121763 0.69 TOP2A (0.55) MAPTMEN1KMT2AHPGDALDH1A1
SCHEMBL2961898 0.69 FTO (0.46) MAPTALDH1A1TOP2A
SCHEMBL442361 0.69 DHODH (0.62) JAK2TYK2ITGB1ITGA4ITGB7
SCHEMBL99535 0.69 HPGD (0.64) MAPTMEN1KMT2ALMNAUSP2
SCHEMBL29656832 0.69 HPGD (0.64) MAPTMEN1KMT2ALMNAUSP2
SCHEMBL460247 0.69 TTR (0.69) JAK2TYK2ITGB1ITGA4ITGB7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7045539-B2 Therapeutic benzoxazole compounds ASTRAZENECA AB (SE) 2006-05-16 US claimed