SCHEMBL19783924

SCHEMBL19783924

OCOCCOCCN1CCC(c2nc3ccccc3[nH]2)CC1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR2B P41595 4/20 0.55
HRH1 P35367 2/20 0.50
CHRNA7 P36544 1/20 0.48
PKM P14618 1/20 0.47
POLB P06746 1/20 0.46
MAPT P10636 1/20 0.46
HSD17B10 Q99714 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL17888859 0.84 HTR2B (0.60) HTR2BHRH1CHRNA7PKM
SCHEMBL17888847 0.84 HTR2B (0.55) HTR2BHRH1CHRNA7POLBMAPT
SCHEMBL17888861 0.84 HTR2B (0.62) HTR2BCHRNA7PKM
SCHEMBL17888844 0.83 HTR2B (0.59) HTR2BHRH1CHRNA7PKMPOLB
SCHEMBL17888851 0.82 HRH1 (0.58) HTR2BHRH1PKMPOLBMAPT
SCHEMBL7533221 0.80 HTR2B (0.60) HTR2BCHRNA7PKM
SCHEMBL14218700 0.76 HTR2B (0.65) HTR2BCHRNA7PKMPOLBMAPT
SCHEMBL7501230 0.75 HTR2B (0.61) HTR2BCHRNA7PKM
SCHEMBL6883705 0.75 PKM (0.62) HTR2BPKM
SCHEMBL9870915 0.74 HTR2B (0.56) HTR2BCHRNA7PKMPOLBMAPT

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-20180016251-A1 NEW BENZIMIDAZOLE DERIVATIVES AS ANTIHISTAMINE AGENTS FAES FARMA, S.A. (ES) 2018-01-18 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-20180016251-A1 NEW BENZIMIDAZOLE DERIVATIVES AS ANTIHISTAMINE AGENTS HRH2, HRH4, HRH1 HTR2B 231/4885HRH1 3/4885CHRNA7 1509/4885

“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.