SCHEMBL3724445

SCHEMBL3724445

O=C(O)NNC(=O)c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.68
NPC1 O15118 3/20 0.68
CTDSP1 Q9GZU7 2/20 0.68
SMN1; SMN2 Q16637 4/20 0.64
POLB P06746 2/20 0.63
KDM4E B2RXH2 1/20 0.63
PTGS2 P35354 2/20 0.61
HDAC3 O15379 1/20 0.58
CA12 O43570 1/20 0.58
CA1 P00915 1/20 0.58
IDO1 P14902 1/20 0.58
ALOX15 P16050 1/20 0.58
HDAC1 Q13547 1/20 0.58
CA9 Q16790 1/20 0.58
HDAC7 Q8WUI4 1/20 0.58
HDAC2 Q92769 1/20 0.58
HSD17B10 Q99714 1/20 0.58
HDAC8 Q9BY41 1/20 0.58
HDAC6 Q9UBN7 1/20 0.58
NCOR2 Q9Y618 1/20 0.58

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
SCHEMBL400890 0.92 RAB9A (0.77) RAB9ANPC1CTDSP1SMN1; SMN2POLB
SCHEMBL12324391 0.90 RAB9A (0.82) RAB9ANPC1CTDSP1SMN1; SMN2POLB
SCHEMBL28875360 0.85 SMN1; SMN2 (0.71) RAB9ANPC1CTDSP1SMN1; SMN2POLB
SCHEMBL5166735 0.84 ALDH1A1 (0.83) RAB9ANPC1CTDSP1SMN1; SMN2POLB
SCHEMBL2834498 0.83 ALDH1A1 (0.60) RAB9ANPC1CTDSP1SMN1; SMN2POLB
SCHEMBL6963750 0.83 RAB9A (0.65) RAB9ANPC1CTDSP1SMN1; SMN2POLB
Malonic Acid SCHEMBL30274338 0.83 RAB9A (0.65) RAB9ANPC1CTDSP1SMN1; SMN2POLB
SCHEMBL10309466 0.83 SMN1; SMN2 (0.74) RAB9ANPC1CTDSP1SMN1; SMN2POLB
SCHEMBL2897981 0.83 RAB9A (0.65) RAB9ANPC1CTDSP1SMN1; SMN2POLB
SCHEMBL16438824 0.82 HDAC3 (0.68) RAB9ANPC1CTDSP1SMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114835849-B Salt-resistant antibacterial polyacrylamide for oil displacement and preparation method thereof 黑龙江吉地油田服务股份有限公司 2023-09-05 CN claimed
EP-0874809-B1 CARBAMOYLOXY DERIVATIVES OF MUTILINE AND THEIR USE AS ANTIBACTERIALS SMITHKLINE BEECHAM PLC (GB) 2003-08-27 EP claimed
US-6239175-B1 Carbamoyloxy derivatives of mutiline and their use as antibacterials SMITHKLINE BEECHAM P.L.C. (GB) 2001-05-29 US claimed
US-5411967-A Antiinflammatory, immunosuppressant, antitumor AMERICAN HOME PRODUCTS CORPORATION (US) 1995-05-02 US claimed
CN-114835849-B Salt-resistant antibacterial polyacrylamide for oil displacement and preparation method thereof 黑龙江吉地油田服务股份有限公司 2023-09-05 CN disclosed
EP-2220042-A1 NOVEL BIFUNCTIONAL COMPOUNDS WHICH INHIBIT PROTEIN KINASES AND HISTONE DEACETYLASES 4SC AG (DE) 2010-08-25 EP disclosed
WO-2009063054-A1 NOVEL BIFUNCTIONAL COMPOUNDS WHICH INHIBIT PROTEIN KINASES AND HISTONE DEACETYLASES 4SC AG (DE) 2009-05-22 WO disclosed
EP-0874809-B1 CARBAMOYLOXY DERIVATIVES OF MUTILINE AND THEIR USE AS ANTIBACTERIALS SMITHKLINE BEECHAM PLC (GB) 2003-08-27 EP disclosed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP disclosed
US-6239175-B1 Carbamoyloxy derivatives of mutiline and their use as antibacterials SMITHKLINE BEECHAM P.L.C. (GB) 2001-05-29 US disclosed
US-6020368-A MICROBIOCIDES HINKS JEREMY DAVID (US) 2000-02-01 US disclosed
EP-0874809-A1 CARBAMOYLOXY DERIVATIVES OF MUTILINE AND THEIR USE AS ANTIBACTERIALS SMITHKLINE BEECHAM PLC (GB) 1998-11-04 EP disclosed
WO-1997025309-A1 CARBAMOYLOXY DERIVATIVES OF MUTILINE AND THEIR USE AS ANTIBACTERIALS SMITHKLINE BEECHAM PLC (GB) 1997-07-17 WO disclosed
US-5411967-A Antiinflammatory, immunosuppressant, antitumor AMERICAN HOME PRODUCTS CORPORATION (US) 1995-05-02 US disclosed