SCHEMBL2073797

SCHEMBL2073797

CN(C)CCCOc1ccccc1CN1CCC(NC(=O)c2ccc(-c3cccc(F)c3)nc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 4/20 0.61
HTR7 P34969 3/20 0.51
UTS2R Q9UKP6 4/20 0.49
MCHR1 Q99705 2/20 0.47
KCNH2 Q12809 1/20 0.47
SSTR5 P35346 5/20 0.46
DRD2 P14416 1/20 0.45
DRD4 P21917 1/20 0.45
HTR2C P28335 1/20 0.44
HTR1A P08908 1/20 0.44

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
SCHEMBL2073790 0.91 HPGDS (0.66) HPGDSHTR7MCHR1SSTR5DRD2
SCHEMBL2070312 0.89 HPGDS (0.66) HPGDSHTR7KCNH2SSTR5DRD2
SCHEMBL2073023 0.88 HPGDS (0.67) HPGDSHTR7SSTR5DRD2DRD4
SCHEMBL2072537 0.88 UTS2R (0.65) HPGDSUTS2RDRD2DRD4
SCHEMBL2072906 0.87 HPGDS (0.62) HPGDSHTR7UTS2RDRD2DRD4
SCHEMBL2071120 0.86 HPGDS (0.64) HPGDSHTR7MCHR1SSTR5DRD2
SCHEMBL2072389 0.85 HPGDS (0.65) HPGDSHTR7MCHR1SSTR5DRD2
SCHEMBL2071100 0.84 HPGDS (0.68) HPGDSHTR7MCHR1SSTR5DRD2
SCHEMBL2071806 0.84 HPGDS (0.65) HPGDSHTR7MCHR1SSTR5HTR2C
SCHEMBL2072522 0.83 HPGDS (0.62) HPGDSHTR7MCHR1SSTR5HTR2C

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 HPGDS 984/4885HTR7 2193/4885UTS2R 1667/4885

“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.