SCHEMBL6633882

SCHEMBL6633882

C/C(CC(C)C)=N\NC(=O)c1cccc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 6/20 0.56
▸ RAB9A P51151 5/20 0.56
▸ MEN1 O00255 5/20 0.56
▸ NPC1 O15118 4/20 0.56
▸ POLB P06746 1/20 0.56
▸ AGTR1 P30556 1/20 0.56
▸ KDM4E B2RXH2 1/20 0.53
▸ PLK1 P53350 1/20 0.51
▸ GAA P10253 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ MMP3 P08254 1/20 0.49
▸ HDAC8 Q9BY41 1/20 0.49
▸ ALDH1A1 P00352 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ MCL1 Q07820 1/20 0.44

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
SCHEMBL1563655 1.00 KMT2A (0.56) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL1563654 1.00 KMT2A (0.56) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL5705734 0.87 SMN1; SMN2 (0.54) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL29586502 0.87 SMN1; SMN2 (0.54) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL2276912 0.87 SMN1; SMN2 (0.54) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL2276914 0.87 SMN1; SMN2 (0.54) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL1563022 0.85 KMT2A (0.60) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL6636696 0.85 KMT2A (0.60) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL1563020 0.85 KMT2A (0.60) KMT2ARAB9AMEN1NPC1POLB
SCHEMBL5705557 0.82 GAA (0.68) KMT2ARAB9AMEN1NPC1POLB

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
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