SCHEMBL21988030

SCHEMBL21988030

Nc1cccc(C2CCCCC2)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 2/20 0.46
DRD2 P14416 2/20 0.46
HTR2A P28223 1/20 0.46
HTR7 P34969 1/20 0.46
BACE1 P56817 1/20 0.45
CNR2 P34972 6/20 0.44
CHRNA7 P36544 1/20 0.43
MCHR1 Q99705 3/20 0.41
HRH4 Q9H3N8 1/20 0.41
DRD4 P21917 1/20 0.40
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
PKM P14618 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ASIC3 Q9UHC3 1/20 0.39
PDE8A O60658 1/20 0.39
NOS3 P29474 1/20 0.39
NOS2 P35228 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
SCHEMBL21117515 1.00 HTR1A (0.46) HTR1ADRD2HTR2AHTR7BACE1
SCHEMBL30279700 1.00 HTR1A (0.46) HTR1ADRD2HTR2AHTR7BACE1
SCHEMBL15091015 0.94 HTR1A (0.41) HTR1ADRD2HTR2AHTR7BACE1
SCHEMBL3925163 0.90 ASIC3 (0.43) HTR1ADRD2HTR2AHTR7CNR2
SCHEMBL29900984 0.90 ASIC3 (0.43) HTR1ADRD2HTR2AHTR7CNR2
SCHEMBL24565129 0.85 HTR1A (0.53) HTR1ADRD2HTR2AHTR7CNR2
SCHEMBL23028116 0.85 HTR1A (0.53) HTR1ADRD2HTR2AHTR7CNR2
SCHEMBL171452 0.81 HRH4 (0.50) HTR1ADRD2HRH4DRD4
SCHEMBL10008729 0.81 HTR1A (0.53) HTR1ADRD2CNR2CHRNA7MCHR1
SCHEMBL627837 0.79 HTR1A (0.41) HTR1ADRD2HTR2AHTR7CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120004785-A Compounds and compositions for the treatment of diseases associated with STING activity 诺华制药股份有限公司 2025-05-16 CN disclosed
CN-112823036-B Compounds and compositions for the treatment of diseases associated with STING activity 艾福姆德尤股份有限公司 2024-11-08 CN disclosed
US-20240083895-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2024-03-14 US disclosed
US-11618749-B2 Compounds and compositions for treating conditions associated with STING activity IFM DUE, INC. (US) 2023-04-04 US disclosed
CN-112823036-A Compounds and compositions for treating diseases associated with STING activity 艾福姆德尤股份有限公司 2021-05-18 CN disclosed
EP-3817820-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM Due, Inc. (US) 2021-05-12 EP disclosed
US-20200172534-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2020-06-04 US disclosed
US-20200172534-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2020-06-04 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 (3 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-20200172534-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 HTR1A 2306/4885DRD2 4335/4885HTR2A 1988/4885
US-11618749-B2 Compounds and compositions for treating conditions associated with STING activity STING1, IRF3, CGAS HTR1A 2417/4885DRD2 4480/4885HTR2A 2164/4885
US-20240083895-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 HTR1A 2306/4885DRD2 4335/4885HTR2A 1988/4885

“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.