SCHEMBL25035506

SCHEMBL25035506

CN1C(=O)CSc2ccc(NC(=O)Nc3c[nH]c4ccccc34)cc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.62
POLB P06746 3/20 0.62
MAPT P10636 13/20 0.61
MEN1 O00255 8/20 0.61
KMT2A Q03164 8/20 0.61
HTT P42858 4/20 0.61
MAPK1 P28482 6/20 0.61
USP2 O75604 5/20 0.61
TP53 P04637 3/20 0.61
ALOX15 P16050 1/20 0.61
SMN1; SMN2 Q16637 4/20 0.61
LMNA P02545 3/20 0.61
NPC1 O15118 2/20 0.61
RAB9A P51151 2/20 0.61
TSHR P16473 1/20 0.61
TAAR1 Q96RJ0 1/20 0.61
OPRM1 P35372 1/20 0.59
OPRD1 P41143 1/20 0.59
CLK1 P49759 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.56

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
SCHEMBL30882833 1.00 ALDH1A1 (0.62) ALDH1A1POLBMAPTMEN1KMT2A
SCHEMBL29979063 0.84 STING1 (0.49) ALDH1A1POLBMAPTMEN1KMT2A
SCHEMBL25138317 0.84 STING1 (0.49) ALDH1A1POLBMAPTMEN1KMT2A
SCHEMBL30882842 0.83 STING1 (0.57) POLBMAPTMEN1KMT2AMAPK1
SCHEMBL25037406 0.83 STING1 (0.57) POLBMAPTMEN1KMT2AMAPK1
SCHEMBL25037514 0.81 STING1 (0.51) ALDH1A1POLBMAPTMEN1KMT2A
SCHEMBL30191392 0.81 STING1 (0.51) ALDH1A1POLBMAPTMEN1KMT2A
SCHEMBL25037517 0.81 STING1 (0.46) ALDH1A1POLBMAPTMEN1KMT2A
SCHEMBL30191932 0.81 STING1 (0.46) ALDH1A1POLBMAPTMEN1KMT2A
SCHEMBL25037515 0.81 MAPT (0.50) ALDH1A1POLBMAPTMEN1KMT2A

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