SCHEMBL21362332

SCHEMBL21362332

Cn1cnc2c(ncn2[C@@H]2C[C@H](OP(=O)(O)O)C[C@H]2OP(=O)(S)OC[C@@H]2C[C@@H](F)[C@H](n3cnc4c(=O)n(C)cnc43)O2)c1=O

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ STING1 Q86WV6 14/20 0.39
▸ TYMP P19971 1/20 0.38

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
SCHEMBL21362245 0.84 STING1 (0.44) STING1
SCHEMBL21362251 0.81 STING1 (0.47) STING1
SCHEMBL24504643 0.80 RNASEL (0.41) STING1TYMP
SCHEMBL21362274 0.80 RNASEL (0.41) STING1TYMP
SCHEMBL21362212 0.75 RNASEL (0.54) STING1
SCHEMBL23692644 0.70 TAS1R3 (0.41) STING1TYMP
SCHEMBL22990411 0.69 STING1 (0.48) STING1
SCHEMBL23692627 0.69 TYMP (0.41) STING1TYMP
SCHEMBL31685307 0.69 P2RY1 (0.51) —
SCHEMBL21133326 0.68 P2RX3 (0.55) STING1TYMP

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
EP-3765474-B1 CYCLOPENTANE-BASED MODULATORS OF STING (STIMULATOR OF INTERFERON GENES) PFIZER (US) 2022-06-15 — — EP disclosed
WO-2019175776-A1 CYCLOPENTANE-BASED MODULATORS OF STING (STIMULATOR OF INTERFERON GENES) PFIZER INC. (US) 2019-09-19 — — WO disclosed
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