SCHEMBL583496

SCHEMBL583496

NCCCCCC(=O)NCCc1ccc(N)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
HDAC3 O15379 3/20 0.56
HDAC1 Q13547 3/20 0.56
HDAC2 Q92769 3/20 0.56
HDAC10 Q969S8 3/20 0.56
HDAC11 Q96DB2 3/20 0.56
HDAC8 Q9BY41 3/20 0.56
HDAC6 Q9UBN7 3/20 0.56
NCOR2 Q9Y618 2/20 0.56
F13A1 P00488 1/20 0.51
STS P08842 2/20 0.51
HSD17B10 Q99714 2/20 0.50
HDAC4 P56524 2/20 0.50
HDAC9 Q9UKV0 2/20 0.50
TRPV1 Q8NER1 1/20 0.50
MEN1 O00255 1/20 0.50
MAPT P10636 1/20 0.50
KMT2A Q03164 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50

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
Fumaric Acid SCHEMBL9786030 0.92 CA1 (0.53) CA1CA2HDAC3HDAC1HDAC2
Fumaric Acid SCHEMBL9786025 0.92 CA1 (0.53) CA1CA2HDAC3HDAC1HDAC2
SCHEMBL9316927 0.88 CA1 (0.60) CA1CA2HDAC3HDAC1HDAC2
SCHEMBL15231871 0.88 CA1 (0.60) CA1CA2HDAC3HDAC1HDAC2
SCHEMBL6413637 0.87 CA1 (0.55) CA1CA2HDAC3HDAC1HDAC2
Hydrochloric Acid SCHEMBL11326814 0.87 CA1 (0.63) CA1CA2HDAC3HDAC1HDAC2
SCHEMBL4896765 0.86 HDAC3 (0.75) CA1CA2HDAC3HDAC1HDAC2
SCHEMBL15358707 0.85 STS (0.64) STSHSD17B10TRPV1MEN1MAPT
SCHEMBL12460593 0.84 CA1 (0.52) CA1CA2HDAC3HDAC1HDAC2
SCHEMBL19865073 0.84 TPSAB1 (0.63) CA1CA2HDAC3HDAC1HDAC2

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2417249-B1 DNA-CELL CONJUGATES UNIV CALIFORNIA (US) 2022-06-08 EP disclosed
CN-113186149-A DNA-cell conjugates 加利福尼亚大学董事会 2021-07-30 CN disclosed
US-10744207-B2 Biological complexes and methods for using same ACEPODIA, INC. (KY) 2020-08-18 US disclosed
US-20180133341-A1 BIOLOGICAL COMPLEXES AND METHODS FOR USING SAME ADHEREN INCORPORATED (US) 2018-05-17 US disclosed
US-9969970-B2 DNA-cell conjugates THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2018-05-15 US disclosed
CN-107326002-A DNA cell conjugates 加利福尼亚大学董事会 2017-11-07 CN disclosed
US-20160319238-A1 DNA-CELL CONJUGATES ENERGY, UNITED STATES DEPARTMENT OF 2016-11-03 US disclosed
US-9327036-B2 DNA-cell conjugates THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-05-03 US disclosed
WO-2015168656-A2 BIOLOGICAL COMPLEXES AND METHODS FOR USING SAME ADHEREN INCORPORATED (US) 2015-11-05 WO disclosed
US-20120142088-A1 DNA-CELL CONJUGATES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-06-07 US disclosed
EP-2417249-A1 DNA-CELL CONJUGATES The Regents of the University of California (US) 2012-02-15 EP disclosed
WO-2010118235-A1 DNA-CELL CONJUGATES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-10-14 WO disclosed