SCHEMBL30191040

SCHEMBL30191040

O=C(Nc1ccc2c(c1)N(Cc1c(F)cccc1Cl)CCS2)Nc1c[nH]c2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 13/20 0.50
MAPT P10636 3/20 0.42
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPK1 P28482 2/20 0.41
MEN1 O00255 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
PTGER3 P43115 1/20 0.39

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
SCHEMBL25037402 1.00 STING1 (0.50) STING1MAPTALDH1A1KDM4EMAPK1
SCHEMBL25037409 0.94 STING1 (0.50) STING1MAPTALDH1A1KDM4EMAPK1
SCHEMBL30191475 0.94 STING1 (0.50) STING1MAPTALDH1A1KDM4EMAPK1
SCHEMBL30191182 0.88 STING1 (0.52) STING1MAPTALDH1A1RAB9A
SCHEMBL25037356 0.88 STING1 (0.52) STING1MAPTALDH1A1RAB9A
SCHEMBL23768825 0.86 MAPT (0.54) STING1MAPTALDH1A1KDM4E
SCHEMBL29978613 0.86 MAPT (0.54) STING1MAPTALDH1A1KDM4E
SCHEMBL25037358 0.85 STING1 (0.48) STING1MAPTALDH1A1KDM4EMAPK1
SCHEMBL30191281 0.85 STING1 (0.48) STING1MAPTALDH1A1KDM4EMAPK1
SCHEMBL25035496 0.85 MAPT (0.53) STING1MAPTALDH1A1KDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4384267-A1 SMALL MOLECULE STING ANTAGONISTS Curadev Pharma Pvt. Ltd. (IN) 2024-06-19 EP claimed
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 claimed