SCHEMBL21391061

SCHEMBL21391061

CC(O)(CC(=O)CCCCc1nc2c(F)cc(C3CC3)cc2n1C1CCC1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACSS2 Q9NR19 2/20 0.33
HDAC1 Q13547 1/20 0.31
BRD4 O60885 4/20 0.31
CREBBP Q92793 4/20 0.31

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
SCHEMBL21391172 0.90 ACSS2 (0.33) ACSS2HDAC1BRD4CREBBP
SCHEMBL21391163 0.90 CYP19A1 (0.32) ACSS2HDAC1BRD4CREBBP
SCHEMBL21391034 0.87 TNKS (0.32) ACSS2HDAC1BRD4CREBBP
SCHEMBL21391063 0.85 HDAC1 (0.36) ACSS2HDAC1
SCHEMBL21391060 0.85 HDAC1 (0.36) ACSS2HDAC1
SCHEMBL21391178 0.85 HDAC1 (0.30) HDAC1
SCHEMBL21390669 0.81 CYP11B2 (0.39) ACSS2HDAC1
SCHEMBL18792006 0.80 EGFR (0.37) ACSS2
SCHEMBL20110984 0.80 EGFR (0.37) ACSS2
SCHEMBL18791999 0.80 EGFR (0.37) ACSS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019183148-A1 KV7 CHANNEL ACTIVATORS COMPOSITIONS AND METHODS OF USE KNOPP BIOSCIENCES LLC (US) 2019-09-26 WO disclosed