SCHEMBL5673107

SCHEMBL5673107

Cc1ccnc(NC(C)CSC[C@H](N)C(=O)O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.45
RAB9A P51151 6/20 0.39
NPC1 O15118 5/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
KIF11 P52732 2/20 0.39
ALDH1A1 P00352 2/20 0.38
TP53 P04637 2/20 0.38
GBA1 P04062 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C19 P33261 1/20 0.38
SORT1 Q99523 1/20 0.38
POLB P06746 1/20 0.37
NOS2 P35228 1/20 0.37
KDM4E B2RXH2 1/20 0.37
HPGD P15428 1/20 0.37
PKM P14618 1/20 0.37
TEAD4 Q15561 1/20 0.36

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
Acetic Acid SCHEMBL6092901 0.98 FDPS (0.43) FDPSRAB9ANPC1SMN1; SMN2MAPT
SCHEMBL6092907 0.85 FDPS (0.41) FDPSRAB9ANPC1SMN1; SMN2MAPT
SCHEMBL5673422 0.84 FDPS (0.41) FDPSRAB9ANPC1SMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL6092755 0.83 FDPS (0.41) FDPSRAB9ANPC1SMN1; SMN2MAPT
SCHEMBL5673108 0.81 NOS2 (0.43) FDPSRAB9ANPC1SMN1; SMN2MAPT
Acetic Acid SCHEMBL6093122 0.79 NOS2 (0.41) FDPSRAB9ANPC1SMN1; SMN2MEN1
SCHEMBL18642520 0.77 FDPS (0.58) FDPSRAB9ANPC1SMN1; SMN2MAPT
SCHEMBL18642522 0.77 FDPS (0.58) FDPSRAB9ANPC1SMN1; SMN2MAPT
Acetic Acid SCHEMBL6090693 0.74 FDPS (0.43) FDPSRAB9ANPC1SMN1; SMN2MAPT
SCHEMBL6091366 0.72 FDPS (0.55) FDPSRAB9ANPC1SMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060270714-A1 Novel n-substituted 2-aminopyridine derivatives ASTRAZENECA AB (SE) 2006-11-30 US claimed
EP-1611100-A1 NOVEL N-SUBSTITUTED 2-AMINOPYRIDINE DERIVATIVES AstraZeneca AB (SE) 2006-01-04 EP claimed
WO-2004087666-A1 NOVEL N-SUBSTITUTED 2-AMINOPYRIDINE DERIVATIVES ASTRAZENECA AB (SE) 2004-10-14 WO claimed
US-20060270714-A1 Novel n-substituted 2-aminopyridine derivatives ASTRAZENECA AB (SE) 2006-11-30 US disclosed
EP-1611100-A1 NOVEL N-SUBSTITUTED 2-AMINOPYRIDINE DERIVATIVES AstraZeneca AB (SE) 2006-01-04 EP disclosed
WO-2004087666-A1 NOVEL N-SUBSTITUTED 2-AMINOPYRIDINE DERIVATIVES ASTRAZENECA AB (SE) 2004-10-14 WO 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-20060270714-A1 Novel n-substituted 2-aminopyridine derivatives NOS1, NOS2, NOS3 FDPS 878/4885RAB9A 559/4885NPC1 4257/4885

“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.