SCHEMBL29979282

SCHEMBL29979282

O=C(Nc1ccc2c(c1)OCC(=O)N2Cc1ccccc1C(F)(F)F)Nc1ccc2cc[nH]c2c1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.41
TSHR P16473 1/20 0.40
IDH1 O75874 1/20 0.40
ITGB3 P05106 5/20 0.39
ITGA2B P08514 5/20 0.39
GAA P10253 2/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
ABL1 P00519 1/20 0.37
TRPV1 Q8NER1 3/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36

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
SCHEMBL23768983 1.00 ESR1 (0.41) ESR1TSHRIDH1ITGB3ITGA2B
SCHEMBL23768999 0.88 TSHR (0.42) ESR1TSHRITGB3ITGA2BGAA
SCHEMBL29978269 0.88 TSHR (0.42) ESR1TSHRITGB3ITGA2BGAA
SCHEMBL29979073 0.86 ITGB3 (0.41) TSHRITGB3ITGA2BGAAKDM4E
SCHEMBL25138351 0.86 ITGB3 (0.41) TSHRITGB3ITGA2BGAAKDM4E
SCHEMBL23769389 0.86 TSHR (0.40) ESR1TSHRITGB3ITGA2BGAA
SCHEMBL25138333 0.86 ITGB3 (0.41) TSHRITGB3ITGA2BGAAKDM4E
SCHEMBL25138342 0.86 ITGB3 (0.42) TSHRITGB3ITGA2BGAAKDM4E
SCHEMBL23769082 0.86 MAPT (0.38) ESR1TSHRIDH1ITGB3ITGA2B
SCHEMBL29979346 0.86 ITGB3 (0.42) TSHRITGB3ITGA2BGAAKDM4E

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
CN-115151304-B Small molecule interferon gene stimulating factor (STING) antagonists 库拉德夫制药私人有限公司 2025-02-11 CN claimed
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 claimed
US-20230124361-A1 SMALL MOLECULE STING ANTAGONISTS CURADEV PHARMA PVT. LTD. (IN) 2023-04-20 US 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 ESR1 4033/4885TSHR 1353/4885IDH1 4241/4885

“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.