SCHEMBL7292469

SCHEMBL7292469

CCN(C(C)=NC(C)C)c1cccc(=O)[nH]1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 4/20 0.34
▸ MMP9 P14780 4/20 0.34
▸ MMP12 P39900 4/20 0.34
▸ MMP2 P08253 3/20 0.34
▸ PTGES O14684 1/20 0.32
▸ GPR84 Q9NQS5 1/20 0.32
▸ NOTUM Q6P988 1/20 0.30

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
SCHEMBL7285845 0.70 MMP1 (0.35) MMP1MMP9MMP12MMP2GPR84
SCHEMBL7294301 0.70 GPR84 (0.36) MMP1MMP9MMP12MMP2GPR84
SCHEMBL7286062 0.67 MAPK14 (0.30) —
SCHEMBL7293169 0.64 MMP1 (0.35) MMP1MMP9MMP12GPR84
SCHEMBL7285267 0.60 PKM (0.47) MMP1MMP9MMP12MMP2NOTUM
SCHEMBL20334042 0.58 ABCB11 (0.35) —
SCHEMBL7286302 0.57 NOTUM (0.36) MMP1MMP9MMP12MMP2GPR84
SCHEMBL10313323 0.57 GPR84 (0.41) MMP1MMP9MMP12MMP2GPR84
SCHEMBL7296669 0.57 GPR84 (0.44) MMP1MMP9MMP12GPR84NOTUM
SCHEMBL31453175 0.56 MMP1 (0.49) MMP1MMP9MMP12MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4863938-A Pyridine derivatives and their use as nootropic agents CIBA-GEIGY CORPORATION (US) 1989-09-05 — — US claimed
EP-0239533-B1 PYRIDINE DERIVATIVES CIBA-GEIGY AG (CH) 1992-09-16 — — EP disclosed
US-4863938-A Pyridine derivatives and their use as nootropic agents CIBA-GEIGY CORPORATION (US) 1989-09-05 — — US disclosed
Send feedback