SCHEMBL6635281

SCHEMBL6635281

CCNNC(=O)c1cccc2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 1/20 0.62
MMP3 P08254 1/20 0.59
HDAC8 Q9BY41 1/20 0.59
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.55
HPGD P15428 2/20 0.55
ALDH1A1 P00352 1/20 0.55
DEGS1 O15121 1/20 0.54
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
NR4A1 P22736 1/20 0.50
NR4A2 P43354 1/20 0.50
NR4A3 Q92570 1/20 0.50
MAPT P10636 1/20 0.49
GAA P10253 1/20 0.49
PTPN1 P18031 1/20 0.49

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
SCHEMBL6636056 0.84 HDAC3 (0.65) PLK1MMP3HDAC8MEN1KMT2A
SCHEMBL6635701 0.84 MMP3 (0.74) PLK1MMP3HDAC8MEN1KMT2A
SCHEMBL2117675 0.83 PLK1 (0.66) PLK1MMP3HDAC8MEN1KMT2A
SCHEMBL6634290 0.83 PLK1 (0.57) PLK1MMP3HDAC8MEN1KMT2A
SCHEMBL6637930 0.82 HDAC1 (0.58) PLK1MMP3HDAC8MEN1KMT2A
SCHEMBL15126359 0.81 PLK1 (0.73) PLK1MMP3HDAC8MEN1KMT2A
SCHEMBL6639442 0.81 ALDH1A1 (0.58) PLK1MMP3HDAC8MEN1KMT2A
SCHEMBL9495226 0.80 PLK1 (0.54) PLK1MMP3HDAC8MEN1KMT2A
SCHEMBL6639039 0.77 CA1 (0.64) MEN1KMT2ASMN1; SMN2HPGDALDH1A1
SCHEMBL145153 0.77 HDAC8 (0.69) PLK1MMP3HDAC8MEN1KMT2A

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
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