SCHEMBL25822155

SCHEMBL25822155

Cc1c(OCCNN)cccc1OCC1CCCCC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.46
HTR1B P28222 1/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
KMT2A Q03164 1/20 0.39
BRD4 O60885 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
SCHEMBL25819244 0.88 HTR1B (0.57) MCHR1HTR1BALDH1A1KDM4EPDE4A
SCHEMBL2206901 0.85 MCHR1 (0.49) MCHR1HTR1BKDM4E
SCHEMBL29818908 0.85 MCHR1 (0.49) MCHR1HTR1BKDM4E
SCHEMBL4568915 0.83 MCHR1 (0.47) MCHR1HTR1B
Ammonia Solution, Strong SCHEMBL4198347 0.79 MCHR1 (0.48) MCHR1ALDH1A1KDM4EKMT2A
SCHEMBL25822152 0.78 PARP10 (0.49) BRD4
SCHEMBL2209601 0.78 KMT2A (0.45) PDE4APDE4BPDE4CPDE4DKMT2A
SCHEMBL19291756 0.76 MCHR1 (0.46) MCHR1
SCHEMBL14858080 0.76 MCHR1 (0.48) MCHR1BRD4
SCHEMBL2207261 0.76 NFKB1 (0.49) MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ACUCELA INC. 2023-07-13 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-20230218549-A1 ALKOXY COMPOUNDS FOR DISEASE TREATMENT ALDH1A2, CLN6, AGER MCHR1 666/4885HTR1B 960/4885ALDH1A1 133/4885

“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.