SCHEMBL6635259

SCHEMBL6635259

CCCCNNC(=O)CCCC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 10/20 0.59
MAPT P10636 4/20 0.50
KMT2A Q03164 3/20 0.50
MEN1 O00255 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
HDAC1 Q13547 8/20 0.47
HDAC2 Q92769 8/20 0.47
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.46
PKM P14618 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
FAAH O00519 4/20 0.45
MAPK1 P28482 1/20 0.45
HSP90AA1 P07900 1/20 0.45
HDAC8 Q9BY41 3/20 0.44
HDAC6 Q9UBN7 2/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
NCOR2 Q9Y618 1/20 0.44
CES2 O00748 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
SCHEMBL6636541 0.91 CASP2 (0.53) HDAC3MAPTKMT2AMEN1NPSR1
SCHEMBL6641767 0.91 HSP90AA1 (0.57) HDAC3MAPTKMT2AMEN1HDAC1
SCHEMBL3357547 0.87 HSP90AA1 (0.57) HDAC3MAPTKMT2AMEN1HDAC1
SCHEMBL6636306 0.87 HSP90AA1 (0.57) HDAC3MAPTKMT2AMEN1HDAC1
SCHEMBL21089636 0.86 GPR84 (0.57) HDAC3MAPTKMT2AMEN1HDAC1
SCHEMBL17399724 0.85 HDAC3 (0.54) HDAC3MAPTKMT2AMEN1NPSR1
SCHEMBL13576498 0.85 HDAC3 (0.50) HDAC3MAPTKMT2AMEN1NPSR1
SCHEMBL6636483 0.84 MAPT (0.52) HDAC3MAPTKMT2AMEN1NPSR1
SCHEMBL20111408 0.84 HDAC3 (0.45) HDAC3MAPTKMT2AMEN1NPSR1
SCHEMBL15694051 0.83 KMT2A (0.65) MAPTKMT2AMEN1NPSR1KDM4E

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-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
CN-1039016-A N '-replacement-N, N '-two replaces the hydrazine insect repellent ROHM & HAAS (US) 1990-01-24 CN disclosed