SCHEMBL880212

SCHEMBL880212

COc1cccc(/C=N/Nc2nc3ccccc3[nH]2)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G10 O15496 1/20 0.72
▸ MGAM O43451 1/20 0.72
▸ PLA2G2A P14555 1/20 0.72
▸ PLA2G5 P39877 1/20 0.72
▸ PLA2G12A Q9BZM1 1/20 0.72
▸ GAA P10253 18/20 0.69
▸ MAPT P10636 18/20 0.69
▸ RAB9A P51151 11/20 0.69
▸ NPC1 O15118 11/20 0.69
▸ KMT2A Q03164 8/20 0.69
▸ MEN1 O00255 7/20 0.69
▸ SMN1; SMN2 Q16637 4/20 0.69
▸ GFER P55789 3/20 0.68
▸ POLB P06746 2/20 0.68
▸ HPGD P15428 2/20 0.68
▸ ALDH1A1 P00352 1/20 0.68
▸ CYP1A2 P05177 1/20 0.68
▸ CYP2D6 P10635 1/20 0.68
▸ CYP2C9 P11712 1/20 0.68
▸ CYP2C19 P33261 1/20 0.68

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
SCHEMBL10280285 0.86 MAPT (0.73) GAAMAPTRAB9ANPC1KMT2A
SCHEMBL10280286 0.82 MAPT (1.00) GAAMAPTRAB9ANPC1KMT2A
SCHEMBL15359675 0.81 MAPT (0.76) GAAMAPTRAB9ANPC1KMT2A
SCHEMBL10280287 0.81 MAPT (0.76) GAAMAPTRAB9ANPC1KMT2A
SCHEMBL12682633 0.81 MAPT (1.00) GAAMAPTRAB9ANPC1KMT2A
SCHEMBL14942678 0.76 MAPT (0.68) GAAMAPTRAB9ANPC1KMT2A
SCHEMBL880223 0.76 GAA (1.00) GAAMAPTRAB9ANPC1KMT2A
SCHEMBL880349 0.75 GAA (1.00) GAAMAPTRAB9ANPC1KMT2A
SCHEMBL880195 0.75 GAA (0.75) GAAMAPTRAB9ANPC1KMT2A
SCHEMBL23906527 0.75 MAPT (0.79) GAAMAPTRAB9ANPC1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8440705-B2 2,3,4,7,8,9-hexahydro-1H-cyclopenta[h]quinolin-2-one or 2,3,4,6,7,8-hexahydro-1H-cyclopenta[g]quinolin-2-one; Alzheimer's disease WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2013-05-14 — — US disclosed
US-8440705-B2 2,3,4,7,8,9-hexahydro-1H-cyclopenta[h]quinolin-2-one or 2,3,4,6,7,8-hexahydro-1H-cyclopenta[g]quinolin-2-one; Alzheimer's disease WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2013-05-14 — — US disclosed
EP-2433634-A2 Compounds, compositions and methods of inhibiting a-synuclein toxicity The Whitehead Institute for Biomedical Research (US) 2012-03-28 — — EP disclosed
US-20080261953-A1 Compounds, Compositions and Methods of Inhibiting Alpha-Synuclein Toxicity WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2008-10-23 — — US disclosed
US-20080261953-A1 Compounds, Compositions and Methods of Inhibiting Alpha-Synuclein Toxicity WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2008-10-23 — — 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-20080261953-A1 Compounds, Compositions and Methods of Inhibiting Alpha-Synuclein Toxicity SNCA, PARK7, HTT PLA2G10 4362/4885MGAM 3157/4885PLA2G2A 4350/4885

“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.

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