SCHEMBL6635162

SCHEMBL6635162

CCCCCCCCCCCCCCCCCC(=O)NNC(=O)c1cccc2ccccc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
POLB P06746 1/20 0.54
HDAC3 O15379 1/20 0.54
HDAC4 P56524 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC7 Q8WUI4 1/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC10 Q969S8 1/20 0.54
HDAC11 Q96DB2 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
HDAC9 Q9UKV0 1/20 0.54
HDAC5 Q9UQL6 1/20 0.54
GSK3B P49841 5/20 0.53
ALDH1A1 P00352 1/20 0.53
GAA P10253 1/20 0.52
PLK1 P53350 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
LMNA P02545 1/20 0.51

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
SCHEMBL6639442 0.90 ALDH1A1 (0.58) MEN1KMT2APOLBHDAC8ALDH1A1
SCHEMBL6637930 0.82 HDAC1 (0.58) MEN1KMT2AHDAC3HDAC1HDAC2
SCHEMBL6633461 0.82 NAAA (0.62) MEN1KMT2APOLBGSK3BGAA
SCHEMBL11315978 0.82 NAAA (0.62) MEN1KMT2APOLBGSK3BGAA
SCHEMBL13990402 0.82 NAAA (0.62) MEN1KMT2APOLBGSK3BGAA
SCHEMBL15732279 0.80 MEN1 (0.60) MEN1KMT2APOLBALDH1A1LMNA
SCHEMBL15658636 0.80 MEN1 (0.60) MEN1KMT2APOLBALDH1A1LMNA
SCHEMBL15655785 0.80 MEN1 (0.60) MEN1KMT2APOLBALDH1A1LMNA
SCHEMBL15659633 0.80 MEN1 (0.60) MEN1KMT2APOLBALDH1A1LMNA
SCHEMBL11352446 0.80 MEN1 (0.60) MEN1KMT2APOLBALDH1A1LMNA

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