SCHEMBL6637074

SCHEMBL6637074

C/C(CC(C)C)=N\NC(=O)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 9/20 0.65
KDM4E B2RXH2 5/20 0.65
MAPT P10636 5/20 0.65
TDP1 Q9NUW8 1/20 0.65
RAB9A P51151 7/20 0.64
NPC1 O15118 5/20 0.58
ALDH1A1 P00352 5/20 0.58
KMT2A Q03164 4/20 0.58
L3MBTL1 Q9Y468 2/20 0.58
MEN1 O00255 2/20 0.58
GLA P06280 1/20 0.58
CYP1A2 P05177 1/20 0.51
CYP3A4 P08684 1/20 0.51
NFKB1 P19838 1/20 0.51
CYP2C19 P33261 1/20 0.51
CASP3 P42574 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
SENP7 Q9BQF6 1/20 0.51
SENP6 Q9GZR1 1/20 0.51

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
SCHEMBL1562806 1.00 SMN1; SMN2 (0.65) SMN1; SMN2KDM4EMAPTTDP1RAB9A
SCHEMBL1562807 1.00 SMN1; SMN2 (0.65) SMN1; SMN2KDM4EMAPTTDP1RAB9A
SCHEMBL22441541 0.89 RAB9A (0.55) SMN1; SMN2KDM4EMAPTTDP1RAB9A
SCHEMBL6635616 0.89 RAB9A (0.55) SMN1; SMN2KDM4EMAPTTDP1RAB9A
SCHEMBL2995779 0.84 KDM4E (0.56) KDM4EMAPTTDP1RAB9AALDH1A1
SCHEMBL2995777 0.84 KDM4E (0.56) KDM4EMAPTTDP1RAB9AALDH1A1
SCHEMBL30826094 0.84 MAPT (0.57) SMN1; SMN2KDM4EMAPTTDP1RAB9A
SCHEMBL27177978 0.84 MAPT (0.57) SMN1; SMN2KDM4EMAPTTDP1RAB9A
SCHEMBL27177972 0.84 MAPT (0.57) SMN1; SMN2KDM4EMAPTTDP1RAB9A
SCHEMBL1563371 0.83 MAPT (0.58) SMN1; SMN2KDM4EMAPTTDP1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0909788-B1 RUBBER COMPOSITION AND PNEUMATIC TIRES BRIDGESTONE CORP (JP) 2004-12-01 EP disclosed
EP-1420044-A2 Rubber composition and pneumatic tire Bridgestone Corporation (JP) 2004-05-19 EP disclosed
US-6380288-B1 LOW HEAT GENERATION PROPERTY, AGING REISTANCE, ALSO FOR PRODUCING VIBRATION ISOLATORS, BELTS AND HOSES AS WELL AS TIRE MATERIALS SUCH AS TIRE TREADS, UNDERTREADS, CARCASSES, SIDE WALLS AND BEADS BRIDGESTONE CORPORATION 2002-04-30 US disclosed
EP-0909788-A1 RUBBER COMPOSITION AND PNEUMATIC TIRES Bridgestone Corporation (JP) 1999-04-21 EP disclosed