SCHEMBL7641390

SCHEMBL7641390

OB(O)c1cccc(/N=N/c2ccc(O)cc2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.55
▸ NPC1 O15118 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ CA12 O43570 1/20 0.54
▸ CA2 P00918 1/20 0.54
▸ GLO1 Q04760 1/20 0.54
▸ CA9 Q16790 1/20 0.54
▸ ENPP2 Q13822 2/20 0.53
▸ HSP90AA1 P07900 1/20 0.50
▸ RAB9A P51151 1/20 0.50

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
SCHEMBL7641392 1.00 MEN1 (0.55) MEN1NPC1KMT2ACA12CA2
SCHEMBL11692429 0.82 MEN1 (0.73) MEN1NPC1KMT2ACA12CA2
SCHEMBL11692422 0.82 MEN1 (0.73) MEN1NPC1KMT2ACA12CA2
SCHEMBL11911194 0.80 ENPP2 (0.49) MEN1KMT2ACA12CA2GLO1
SCHEMBL29267948 0.78 MEN1 (0.67) MEN1NPC1KMT2ACA12CA2
SCHEMBL29267949 0.78 MEN1 (0.67) MEN1NPC1KMT2ACA12CA2
SCHEMBL7643840 0.77 KDM4E (0.53) MEN1NPC1KMT2AENPP2
SCHEMBL7643843 0.77 KDM4E (0.53) MEN1NPC1KMT2AENPP2
SCHEMBL4850919 0.77 KMT2A (0.61) MEN1NPC1KMT2ACA12CA2
SCHEMBL670458 0.74 HTR3E (0.43) MEN1KMT2AENPP2

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-6448238-B1 BORONIC ACIDS USED WITH BETA-LACTAM ANTIBIOTICS, SUCH AS AMOXICILLIN OR CEFTAZIDIME, TO TREAT BETA-LACTAM ANTIBIOTIC RESISTANT BACTERIAL INFECTIONS NORTHWESTERN UNIVERSITY 2002-09-10 — — US claimed
US-6448238-B1 BORONIC ACIDS USED WITH BETA-LACTAM ANTIBIOTICS, SUCH AS AMOXICILLIN OR CEFTAZIDIME, TO TREAT BETA-LACTAM ANTIBIOTIC RESISTANT BACTERIAL INFECTIONS NORTHWESTERN UNIVERSITY 2002-09-10 — — US disclosed
US-6184363-B1 Inhibitors of β-lactamases and uses therefor NORTHWESTERN UNIVERSITY 2001-02-06 — — US disclosed
Send feedback