SCHEMBL23612239

SCHEMBL23612239

Nc1c[nH]c2ccc(C(F)F)cc12

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTR1D P28221 4/20 0.44
▸ KIF11 P52732 1/20 0.40
▸ HTR1B P28222 3/20 0.39
▸ HTR2A P28223 7/20 0.37
▸ HTR2C P28335 4/20 0.37
▸ HTR2B P41595 3/20 0.36
▸ HTR1A P08908 2/20 0.36
▸ MPO P05164 2/20 0.35
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ TRPM8 Q7Z2W7 1/20 0.33
▸ GPR84 Q9NQS5 1/20 0.33

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
Hydrochloric Acid SCHEMBL23612170 0.98 HTR1D (0.43) HTR1DKIF11HTR1BHTR2AHTR2C
Hydrochloric Acid SCHEMBL29988859 0.98 HTR1D (0.43) HTR1DKIF11HTR1BHTR2AHTR2C
Hydrochloric Acid SCHEMBL23612169 0.96 HTR1D (0.42) HTR1DKIF11HTR1BHTR2AHTR2C
SCHEMBL14555321 0.78 ATM (0.47) HTR1DKIF11HTR1BHTR2AHTR2C
SCHEMBL29234445 0.77 HTR1D (0.41) HTR1DHTR1BHTR2AHTR2CHTR2B
SCHEMBL14555351 0.76 HTR1D (0.46) HTR1DKIF11HTR1BHTR2AHTR2C
SCHEMBL3624363 0.75 MPO (0.59) HTR2AHTR2CHTR2BHTR1AMPO
SCHEMBL8628537 0.74 HPGD (0.49) HTR1DHTR1BHTR2AHTR2CHTR1A
SCHEMBL17066884 0.74 HTR1D (0.55) HTR1DHTR1BHTR2AHTR2CHTR2B
SCHEMBL23612200 0.71 MEN1 (0.36) HTR1DKIF11HTR1BCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230127839-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-04-27 — — US disclosed
US-20230127839-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-04-27 — — US disclosed
US-20230127839-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2023-04-27 — — US disclosed
CN-115348957-A Compounds and compositions for treating diseases associated with STING activity 艾福姆德尤股份有限公司 2022-11-15 — — CN disclosed
EP-4085051-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM Due, Inc. (US) 2022-11-09 — — EP disclosed
WO-2021138434-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2021-07-08 — — WO disclosed
WO-2021138434-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2021-07-08 — — 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-20230127839-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 HTR1D 3331/4885KIF11 4125/4885HTR1B 2912/4885

“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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