SCHEMBL6634874

SCHEMBL6634874

CCCCCCCCCCCCCCCCCC(=O)NNc1cccc2ccccc12

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 1/20 0.68
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
EP300 Q09472 1/20 0.51
KDM4E B2RXH2 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
EPHX2 P34913 1/20 0.50
CETP P11597 1/20 0.50
HDAC3 O15379 1/20 0.49
HDAC4 P56524 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC7 Q8WUI4 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC10 Q969S8 1/20 0.49
HDAC11 Q96DB2 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
HDAC9 Q9UKV0 1/20 0.49
HDAC5 Q9UQL6 1/20 0.49
SOAT1 P35610 2/20 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
SCHEMBL8208778 1.00 P2RX7 (0.68) P2RX7KMT2AMEN1EP300KDM4E
SCHEMBL6633161 0.94 P2RX7 (0.59) P2RX7KMT2AKDM4EL3MBTL1CETP
SCHEMBL31091435 0.84 EP300 (0.66) KMT2AEP300KDM4EL3MBTL1CETP
SCHEMBL5923550 0.81 P2RX7 (1.00) P2RX7KMT2AMEN1EP300KDM4E
SCHEMBL23048462 0.80 CYP1A2 (0.67) KMT2AEP300KDM4EL3MBTL1CETP
SCHEMBL5923449 0.80 P2RX7 (0.97) P2RX7KMT2AMEN1KDM4ECETP
SCHEMBL6635162 0.80 MEN1 (0.55) KMT2AMEN1HDAC3HDAC4HDAC1
SCHEMBL14282880 0.80 EP300 (0.56) KMT2AEP300KDM4EL3MBTL1CETP
SCHEMBL11408794 0.79 SOAT1 (0.64) KMT2AEP300KDM4EL3MBTL1EPHX2
SCHEMBL5459899 0.79 ALDH1A1 (0.63) KMT2AEP300KDM4EL3MBTL1HDAC3

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