SCHEMBL7432189

SCHEMBL7432189

CC1CCCCC1(N)C(=O)NO

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 9/20 0.33
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HTT P42858 1/20 0.31
EPHX1 P07099 1/20 0.31
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL16594983 0.79 EPHX1 (0.38) EPHX1
SCHEMBL2899251 0.79 GRM2 (0.40)
SCHEMBL10392022 0.79 GRM2 (0.40)
SCHEMBL12662227 0.78 MAPT (0.41) TDP1
Hydrochloric Acid SCHEMBL3129049 0.77 ARG1 (0.39)
Hydrochloric Acid SCHEMBL3484004 0.76 MAPT (0.41) TDP1
SCHEMBL2901770 0.72 ARG1 (0.45) TDP1
SCHEMBL27667817 0.71 KMT2A (0.36) HTTTDP1
Hydrochloric Acid SCHEMBL1632919 0.71 ARG1 (0.44)
SCHEMBL20103922 0.70 ALDH1A1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1147078-A1 ACETYLENIC (BETA)-SULFONAMIDO AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS American Cyanamid Company (US) 2001-10-24 EP disclosed
WO-2000044711-A1 ACETYLENIC $G(b)-SULFONAMIDO AND PHOSPHINIC ACID AMIDE HYDROXAMIC ACID TACE INHIBITORS AMERICAN CYANAMID COMPANY (US) 2000-08-03 WO disclosed