SCHEMBL23769068

SCHEMBL23769068

C=CCC1COc2ccc([N+](=O)[O-])cc2N1Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ CASP1 P29466 1/20 0.39
▸ CASP3 P42574 1/20 0.39
▸ CASP4 P49662 1/20 0.39
▸ CASP7 P55210 1/20 0.39
▸ CASP9 P55211 1/20 0.39
▸ CASP6 P55212 1/20 0.39
▸ CASP8 Q14790 1/20 0.39
▸ DHFR P00374 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ MAPT P10636 5/20 0.38
▸ HTT P42858 1/20 0.38
▸ ACHE P22303 3/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ MAPK1 P28482 1/20 0.37

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
SCHEMBL29979518 1.00 POLB (0.40) POLBKMT2ACASP1CASP3CASP4
SCHEMBL28914142 0.84 KMT2A (0.41) POLBKMT2ACASP1CASP3CASP4
SCHEMBL31490134 0.81 DRD2 (0.34) DHFRCYP2D6RAB9A
SCHEMBL23769078 0.81 DRD2 (0.34) DHFRCYP2D6RAB9A
SCHEMBL25138303 0.81 POLB (0.46) POLBKMT2ACASP1CASP3CASP4
SCHEMBL23769065 0.81 KMT2A (0.38) POLBKMT2ACASP1CASP3CASP4
SCHEMBL31490100 0.81 KMT2A (0.38) POLBKMT2ACASP1CASP3CASP4
SCHEMBL23769120 0.79 HTT (0.36) HTTTDP1RAB9AALDH1A1
SCHEMBL31490139 0.79 KMT2A (0.41) POLBKMT2ACASP1CASP3CASP4
SCHEMBL23769124 0.79 KMT2A (0.41) POLBKMT2ACASP1CASP3CASP4

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
US-20230124361-A1 SMALL MOLECULE STING ANTAGONISTS CURADEV PHARMA PVT. LTD. (IN) 2023-04-20 — — US disclosed
CN-115151304-A Small molecule interferon gene stimulating factor (STING) antagonists 库拉德夫制药私人有限公司 2022-10-04 — — CN disclosed
WO-2021161230-A1 SMALL MOLECULE STING ANTAGONISTS CURADEV PHARMA PVT. LTD. (IN) 2021-08-19 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230124361-A1 SMALL MOLECULE STING ANTAGONISTS STING1, CGAS, MAVS POLB 2319/4885KMT2A 4579/4885CASP1 212/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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