SCHEMBL2073050

SCHEMBL2073050

O=C(NC1CCN(C(=O)O)CC1)c1ccc(-c2cccc(F)c2)nc1

nearest known ligand 0.72

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 6/20 0.72
USP30 Q70CQ3 1/20 0.54
DRD2 P14416 1/20 0.49
DRD4 P21917 1/20 0.49
GRM5 P41594 1/20 0.49
MAP4K4 O95819 1/20 0.48
GABRA5 P31644 2/20 0.47
HTR7 P34969 1/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 1/20 0.47

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
SCHEMBL14190145 0.89 HPGDS (0.75) HPGDSUSP30DRD2DRD4GRM5
SCHEMBL1543340 0.89 HPGDS (0.74) HPGDSUSP30GRM5MAP4K4GABRA5
SCHEMBL2070076 0.89 HPGDS (0.72) HPGDSUSP30DRD2DRD4GRM5
SCHEMBL2072921 0.88 HPGDS (0.74) HPGDSUSP30GRM5MAP4K4GABRA5
SCHEMBL2072588 0.88 HPGDS (0.68) HPGDSUSP30DRD2DRD4GRM5
SCHEMBL1543455 0.87 HPGDS (0.68) HPGDSUSP30GRM5MAP4K4GABRA5
SCHEMBL1543648 0.87 HPGDS (0.71) HPGDSGRM5MAP4K4GABRA5
SCHEMBL2073484 0.87 HPGDS (0.71) HPGDSUSP30DRD2DRD4GRM5
SCHEMBL2072958 0.86 HPGDS (0.68) HPGDSUSP30DRD2DRD4MAP4K4
SCHEMBL2996580 0.86 HPGDS (0.65) HPGDSUSP30GRM5MAP4K4GABRA5

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 984/4885USP30 4416/4885DRD2 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.