SCHEMBL8529801

SCHEMBL8529801

CC(=NO)c1ncc(C)nc1C

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 1/20 0.35
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 1/20 0.30

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
SCHEMBL27261811 1.00 JAK3 (0.35) JAK3KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL8529798 1.00 JAK3 (0.35) JAK3KDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL2491805 0.75 SMN1; SMN2 (0.40) JAK3KDM4ERAB9ASMN1; SMN2POLB
SCHEMBL7702136 0.75 JAK3 (0.37) JAK3SMN1; SMN2
SCHEMBL7422568 0.71 HPGD (0.39) JAK3KDM4ESMN1; SMN2
SCHEMBL5069987 0.71 JAK3 (0.34) JAK3POLB
SCHEMBL3460085 0.69 SIRT3 (0.37) JAK3KDM4EPOLB
SCHEMBL4638784 0.68 JAK3 (0.35) JAK3KDM4ESMN1; SMN2POLB
SCHEMBL11201451 0.67 MAPKAPK2 (0.35) JAK3KDM4EPOLB
Methyl Alcohol SCHEMBL16458351 0.66 JAK3 (0.42) JAK3KDM4ESMN1; 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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5763640-A OXIMINOMETHYLPHENYL DERIVATIVES ZENECA LIMITED (GB) 1998-06-09 US disclosed
EP-0370629-B2 Fungicides ZENECA LTD (GB) 1998-01-07 EP disclosed
US-5631253-A FUNGICIDES, INSECTICIDES AND MITICIDES USING METHYLOXIME PHENYLPROPENOIC ACID ZENECA LIMITED (GB) 1997-05-20 US disclosed
US-5432197-A Insecticidal, miticidal ZENECA LIMITED (GB) 1995-07-11 US disclosed
US-5371084-A Insecticides and miticides ZENECA LIMITED (GB) 1994-12-06 US disclosed
CN-1024005-C Fungicidal agents ICI PLC (GB) 1994-03-16 CN disclosed
EP-0506149-A2 Fungicides ZENECA LIMITED (GB) 1992-09-30 EP disclosed
US-5055471-A FUNGICIDES IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1991-10-08 US disclosed
CN-1042900-A Mycocide ICI PLC (GB) 1990-06-13 CN disclosed
EP-0370629-A1 Fungicides ZENECA LIMITED (GB) 1990-05-30 EP disclosed