SCHEMBL12844288

SCHEMBL12844288

CCCc1ccccc1OCCCN(C)C

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.65
HTR1B P28222 1/20 0.55
DRD2 P14416 1/20 0.54
DRD1 P21728 1/20 0.54
DRD4 P21917 1/20 0.54
DRD5 P21918 1/20 0.54

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
SCHEMBL11254068 0.89 HRH1 (0.63) HRH1HTR1BDRD2DRD1DRD4
SCHEMBL3066804 0.87 HRH1 (0.56) HRH1DRD2DRD1DRD4DRD5
SCHEMBL3058007 0.85 DRD2 (0.55) HRH1DRD2DRD1DRD4DRD5
SCHEMBL7999552 0.84 PPARD (0.60)
SCHEMBL11253910 0.84 HRH1 (0.75) HRH1DRD2DRD1DRD4DRD5
SCHEMBL8703033 0.84 HRH1 (0.61) HRH1HTR1BDRD2DRD1DRD4
SCHEMBL11259882 0.84 HRH1 (0.57) HRH1HTR1BDRD2DRD1DRD4
SCHEMBL8698766 0.83 HRH1 (0.69) HRH1HTR1BDRD2DRD1DRD4
Hydrochloric Acid SCHEMBL11256997 0.83 HRH1 (0.73) HRH1DRD2DRD1DRD4DRD5
SCHEMBL11250748 0.83 HRH1 (0.60) HRH1HTR1BDRD2DRD1DRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7902373-B2 asthma; for treating prostaglandin D2 mediated diseases; e.g. 6-(3-fluorophenyl)-N-[1-(1-methyl-1H-tetrazol-5-yl)piperidin-4-yl]nicotinamide PFIZER INC (US) 2011-03-08 US disclosed
US-20080146569-A1 Nicotinamide Derivatives PFIZER INC. 2008-06-19 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-20080146569-A1 Nicotinamide Derivatives NNT, NAMPT, NADK HRH1 596/4885HTR1B 1551/4885DRD2 2709/4885

“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.