SCHEMBL6640133

SCHEMBL6640133

CCCCCCCCCCCCCCCCCCNNC(=O)c1ccccc1

nearest known ligand 0.77

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 17/20 0.77
HDAC1 Q13547 13/20 0.74
HDAC2 Q92769 13/20 0.74
HDAC8 Q9BY41 5/20 0.72
NCOR2 Q9Y618 3/20 0.72
NAAA Q02083 1/20 0.71
HDAC11 Q96DB2 3/20 0.68
HDAC10 Q969S8 1/20 0.62
HDAC6 Q9UBN7 1/20 0.62

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
SCHEMBL4415910 0.98 HDAC3 (0.76) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL6636519 0.93 HDAC3 (0.82) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL17141819 0.89 HDAC3 (0.91) HDAC3HDAC1HDAC2HDAC8NCOR2
SCHEMBL21435734 0.88 HDAC3 (1.00) HDAC3HDAC1HDAC2HDAC8NAAA
SCHEMBL21435742 0.88 HDAC3 (1.00) HDAC3HDAC1HDAC2HDAC8NAAA
SCHEMBL21435717 0.88 HDAC3 (1.00) HDAC3HDAC1HDAC2HDAC8NAAA
SCHEMBL28970457 0.88 HDAC3 (1.00) HDAC3HDAC1HDAC2HDAC8NAAA
SCHEMBL21435731 0.88 HDAC3 (1.00) HDAC3HDAC1HDAC2HDAC8NAAA
SCHEMBL28970454 0.88 HDAC3 (1.00) HDAC3HDAC1HDAC2HDAC8NAAA
SCHEMBL28970469 0.88 HDAC3 (1.00) HDAC3HDAC1HDAC2HDAC8NAAA

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