SCHEMBL23769104

SCHEMBL23769104

CC1c2ccc(C(N)=O)cc2N(Cc2ccccc2)C(=O)N1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 1/20 0.48
HDAC6 Q9UBN7 4/20 0.45
HDAC3 O15379 3/20 0.45
HDAC4 P56524 3/20 0.45
HDAC1 Q13547 3/20 0.45
HDAC7 Q8WUI4 3/20 0.45
HDAC2 Q92769 3/20 0.45
HDAC10 Q969S8 3/20 0.45
HDAC11 Q96DB2 3/20 0.45
HDAC8 Q9BY41 3/20 0.45
HDAC9 Q9UKV0 3/20 0.45
HDAC5 Q9UQL6 3/20 0.45
OPRK1 P41145 4/20 0.43
KMT2A Q03164 3/20 0.43
OPRM1 P35372 3/20 0.43
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
CTRB1 P17538 1/20 0.42
CACNA1G O43497 1/20 0.41
CACNA1H O95180 1/20 0.41

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
SCHEMBL25138410 1.00 STING1 (0.48) STING1HDAC6HDAC3HDAC4HDAC1
SCHEMBL23769102 0.91 STING1 (0.50) STING1HDAC6KMT2AMEN1POLB
SCHEMBL29256261 0.91 STING1 (0.50) STING1HDAC6KMT2AMEN1POLB
SCHEMBL23769096 0.86 STING1 (0.49) STING1HDAC6KMT2AMEN1POLB
SCHEMBL23769101 0.86 STING1 (0.49) STING1HDAC6KMT2AMEN1POLB
SCHEMBL30128427 0.84 STING1 (0.61) STING1HDAC6HDAC2HDAC8KMT2A
SCHEMBL21932185 0.84 STING1 (0.61) STING1HDAC6HDAC2HDAC8KMT2A
SCHEMBL29256253 0.83 ELANE (0.41) STING1HDAC6KMT2AMEN1POLB
SCHEMBL29256250 0.83 ELANE (0.41) STING1HDAC6KMT2AMEN1POLB
SCHEMBL23768984 0.83 STING1 (0.45) STING1HDAC6KMT2AMEN1POLB

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-2021161230-A1 SMALL MOLECULE STING ANTAGONISTS CURADEV PHARMA PVT. LTD. (IN) 2021-08-19 WO disclosed