SCHEMBL25037520

SCHEMBL25037520

NC(=O)c1ccccc1CN1C(=O)CSc2ccc(NC(=O)Nc3c[nH]c4ccccc34)cc21

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 11/20 0.45
TP53 P04637 3/20 0.41
MAPT P10636 3/20 0.40
HTT P42858 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
MAPK1 P28482 3/20 0.40
USP2 O75604 2/20 0.40
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
TSHR P16473 1/20 0.40
RAB9A P51151 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
ALOX15 P16050 1/20 0.40

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
SCHEMBL30191259 1.00 STING1 (0.45) STING1TP53MAPTHTTMEN1
SCHEMBL29256217 0.87 MAPT (0.45) STING1TP53MAPTHTTMEN1
SCHEMBL30191380 0.87 MAPT (0.45) STING1TP53MAPTHTTMEN1
SCHEMBL29256231 0.87 STING1 (0.47) STING1TP53MAPTHTTMEN1
SCHEMBL25138317 0.87 STING1 (0.49) STING1MAPTHTTMEN1KMT2A
SCHEMBL29979063 0.87 STING1 (0.49) STING1MAPTHTTMEN1KMT2A
SCHEMBL25037514 0.84 STING1 (0.51) STING1MAPTHTTMEN1KMT2A
SCHEMBL25037517 0.84 STING1 (0.46) STING1TP53MAPTHTTMEN1
SCHEMBL30191932 0.84 STING1 (0.46) STING1TP53MAPTHTTMEN1
SCHEMBL30191392 0.84 STING1 (0.51) STING1MAPTHTTMEN1KMT2A

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
CN-118159535-A Small molecule STING antagonists 库拉德夫制药私人有限公司 2024-06-07 CN claimed
WO-2023017451-A1 SMALL MOLECULE STING ANTAGONISTS CURADEV PHARMA PVT. LTD. (IN) 2023-02-16 WO disclosed