SCHEMBL11325708

SCHEMBL11325708

O=C(NNC(=O)c1cc(C2CCCCCCC2)ccc1O)c1cc(C2CCCCCCC2)ccc1O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACMSD Q8TDX5 2/20 0.71
DEGS1 O15121 2/20 0.49
HDAC8 Q9BY41 3/20 0.46
HDAC6 Q9UBN7 2/20 0.46
HDAC1 Q13547 1/20 0.46
KDM4E B2RXH2 2/20 0.46
LMNA P02545 2/20 0.46
HTT P42858 2/20 0.46
MAPK1 P28482 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HDAC4 P56524 1/20 0.45
HDAC2 Q92769 1/20 0.45
SERPINE1 P05121 2/20 0.44
KMO O15229 1/20 0.44
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
NPC1 O15118 2/20 0.43
GAA P10253 1/20 0.43
SENP1 Q9P0U3 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL11312879 1.00 ACMSD (0.71) ACMSDDEGS1HDAC8HDAC6HDAC1
SCHEMBL24605452 0.87 ACMSD (0.69) ACMSDDEGS1HDAC8HDAC6HDAC1
SCHEMBL2533359 0.83 ACMSD (1.00) ACMSDHDAC8KDM4EHTTSMN1; SMN2
SCHEMBL27965931 0.83 ACMSD (1.00) ACMSDHDAC8KDM4EHTTSMN1; SMN2
SCHEMBL7499690 0.82 ACMSD (0.73) ACMSDDEGS1HDAC8HDAC6HDAC1
SCHEMBL10886997 0.78 ACMSD (0.68) ACMSDDEGS1HDAC8HDAC6HDAC1
SCHEMBL19013936 0.76 HDAC8 (0.57) ACMSDDEGS1HDAC8HDAC6HDAC1
SCHEMBL1856511 0.75 ACMSD (0.53) ACMSDKDM4ELMNASMN1; SMN2ALDH1A1
SCHEMBL68815 0.75 QDPR (0.66) ACMSDHDAC8HDAC4HDAC2SERPINE1
SCHEMBL9450662 0.75 ACMSD (0.76) ACMSDHDAC8KDM4ELMNAHTT

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
US-4306930-A INCORPORATING A HYDRAZIDE OR DIHYDRAZIDE AND THEN VULCANIZING IN CONTACT WITH A METAL CIBA-GEIGY CORPORATION (US) 1981-12-22 US disclosed
US-4077948-A N-SALICYLIDENE-N*-SALICYLHYDRAZIDES CIBA-GEIGY CORPORATION (US) 1978-03-07 US disclosed
US-3994987-A Metal deactivators as adhesion promotors for vulcanizable elastomers to metals CIBA-GEIGY CORPORATION (US) 1976-11-30 US disclosed