SCHEMBL880329

SCHEMBL880329

CSc1nc2cc(-c3ccccc3)ccc2o1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.66
L3MBTL1 Q9Y468 1/20 0.66
ELANE P08246 1/20 0.49
HPGD P15428 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
CASP3 P42574 2/20 0.47
SENP7 Q9BQF6 2/20 0.47
SENP6 Q9GZR1 2/20 0.47
TDP1 Q9NUW8 1/20 0.47
KDM4E B2RXH2 1/20 0.47
NPC1 O15118 1/20 0.47
POLB P06746 1/20 0.47
RAB9A P51151 1/20 0.47
SENP8 Q96LD8 1/20 0.47
MEN1 O00255 1/20 0.43
ALDH1A1 P00352 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
AAK1 Q2M2I8 1/20 0.43
PGR P06401 1/20 0.42

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
SCHEMBL4699862 0.83 KDM4E (0.50) GAAL3MBTL1HPGDSMN1; SMN2KDM4E
SCHEMBL31294102 0.80 L3MBTL1 (0.56) GAAL3MBTL1HPGDSMN1; SMN2CASP3
SCHEMBL30612644 0.79 L3MBTL1 (1.00) GAAL3MBTL1ELANEHPGDSMN1; SMN2
SCHEMBL1634416 0.79 L3MBTL1 (1.00) GAAL3MBTL1ELANEHPGDSMN1; SMN2
SCHEMBL303847 0.78 ELANE (0.58) L3MBTL1ELANEHPGDSMN1; SMN2TDP1
SCHEMBL31155591 0.78 ELANE (0.58) L3MBTL1ELANEHPGDSMN1; SMN2TDP1
SCHEMBL30602943 0.77 NPC1 (0.54) L3MBTL1HPGDSMN1; SMN2CASP3SENP7
SCHEMBL539051 0.77 NPC1 (0.54) L3MBTL1HPGDSMN1; SMN2CASP3SENP7
SCHEMBL7905531 0.77 SMN1; SMN2 (0.70) GAAL3MBTL1HPGDSMN1; SMN2CASP3
SCHEMBL2244575 0.77 SMN1; SMN2 (0.70) GAAL3MBTL1HPGDSMN1; SMN2CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113166161-B Compounds having PDE9A inhibiting activity and pharmaceutical uses thereof 韩国化学研究院 2023-10-27 CN 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
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
EP-1802303-B1 COMPOUNDS, COMPOSITIONS AND METHODS OF INHIBITING A-SYNUCLEIN TOXICITY WHITEHEAD BIOMEDICAL INST (US) 2011-11-02 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
EP-0324717-B1 NEGATIVE-WORKING SILVER HALIDE EMULSION CONTAINING CERTAIN MONOMETHINE COMPOUNDS ILFORD Limited (GB) 1992-04-29 EP disclosed
US-4996141-A In silver halide negative emulsion ILFORD LIMITED (GB) 1991-02-26 US disclosed
EP-0324717-A1 Negative-working silver halide emulsion containing certain monomethine compounds ILFORD Limited (GB) 1989-07-19 EP 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 GAA 62/4885L3MBTL1 244/4885ELANE 2648/4885

“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.