SCHEMBL1822607

SCHEMBL1822607

O=C1CCCC(N2CC2)C1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.45
SIGMAR1 Q99720 1/20 0.36
MAPT P10636 1/20 0.35
THRB P10828 1/20 0.34
OPRM1 P35372 2/20 0.34
OPRL1 P41146 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
MPO P05164 1/20 0.33
TRIM24 O15164 1/20 0.33
TRIM33 Q9UPN9 1/20 0.33
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
L3MBTL3 Q96JM7 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.32

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
SCHEMBL11008209 0.93 MAPK1 (0.43) MAPK1ALDH1A1L3MBTL3L3MBTL1
SCHEMBL11003669 0.91 MAPK1 (0.42) MAPK1OPRM1OPRL1MEN1KMT2A
SCHEMBL131020 0.90 MAPK1 (0.47) MAPK1SIGMAR1MAPTTHRBOPRM1
SCHEMBL863778 0.89 MAPK1 (0.43) MAPK1OPRM1OPRL1MPOTRIM24
SCHEMBL863645 0.87 MAPK1 (0.42) MAPK1OPRM1OPRL1MEN1KMT2A
SCHEMBL131067 0.86 SMN1; SMN2 (0.44) MAPK1MAPTOPRL1MEN1KMT2A
SCHEMBL132371 0.86 MAPK1 (0.43) MAPK1SIGMAR1THRBTSHR
SCHEMBL30761740 0.85 MAPK1 (0.41) MAPK1OPRM1OPRL1MEN1KMT2A
SCHEMBL30475621 0.85 MAPK1 (0.41) MAPK1OPRM1OPRL1MEN1KMT2A
SCHEMBL5250892 0.84 MAPK1 (0.43) MAPK1OPRM1OPRL1MPOALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2315748-B1 PROCESSES FOR THE PREPARATION OF 4-OXO-OCTAHYDRO-INDOLE-1-CARBOCYLIC ACID METHYL ESTER AND DERIVATIVES THEREOF NOVARTIS AG (CH) 2015-06-24 EP disclosed
EP-2315748-B1 PROCESSES FOR THE PREPARATION OF 4-OXO-OCTAHYDRO-INDOLE-1-CARBOCYLIC ACID METHYL ESTER AND DERIVATIVES THEREOF NOVARTIS AG (CH) 2015-06-24 EP disclosed
EP-2650284-A1 Heterocyclic derivatives as metabotropic glutamate receptor modulators Merz Pharma GmbH & Co. KGaA (DE) 2013-10-16 EP disclosed
US-8084487-B2 Processes for the preparation of 4-oxo-octahydro-indole-1-carbocyclic acid methyl ester and derivatives thereof NOVARTIS AG (CH) 2011-12-27 US disclosed
US-8084487-B2 Processes for the preparation of 4-oxo-octahydro-indole-1-carbocyclic acid methyl ester and derivatives thereof NOVARTIS AG (CH) 2011-12-27 US disclosed
US-8084487-B2 Processes for the preparation of 4-oxo-octahydro-indole-1-carbocyclic acid methyl ester and derivatives thereof NOVARTIS AG (CH) 2011-12-27 US disclosed
US-20110144352-A1 PROCESSES FOR THE PREPARATION OF 4-OXO-OCTAHYDRO-INDOLE-1-CARBOCYCLIC ACID METHYL ESTER AND DERIVATIVES THEREOF NOVARTIS AG (CH) 2011-06-16 US disclosed
US-20110144352-A1 PROCESSES FOR THE PREPARATION OF 4-OXO-OCTAHYDRO-INDOLE-1-CARBOCYCLIC ACID METHYL ESTER AND DERIVATIVES THEREOF NOVARTIS AG (CH) 2011-06-16 US disclosed
US-20110144352-A1 PROCESSES FOR THE PREPARATION OF 4-OXO-OCTAHYDRO-INDOLE-1-CARBOCYCLIC ACID METHYL ESTER AND DERIVATIVES THEREOF NOVARTIS AG (CH) 2011-06-16 US disclosed
EP-2315748-A1 PROCESSES FOR THE PREPARATION OF 4-OXO-OCTAHYDRO-INDOLE-1-CARBOCYLIC ACID METHYL ESTER AND DERIVATIVES THEREOF Novartis AG (CH) 2011-05-04 EP disclosed
WO-2010018154-A1 PROCESSES FOR THE PREPARATION OF 4-OXO-OCTAHYDRO-INDOLE-1-CARBOCYLIC ACID METHYL ESTER AND DERIVATIVES THEREOF NOVARTIS AG (CH) 2010-02-18 WO disclosed
WO-2010018154-A1 PROCESSES FOR THE PREPARATION OF 4-OXO-OCTAHYDRO-INDOLE-1-CARBOCYLIC ACID METHYL ESTER AND DERIVATIVES THEREOF NOVARTIS AG (CH) 2010-02-18 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-20110144352-A1 PROCESSES FOR THE PREPARATION OF 4-OXO-OCTAHYDRO-INDOLE-1-CARBOCYCLIC ACID METHYL ESTER AND DERIVATIVES THEREOF KMO, IDO1, ALKBH3 MAPK1 2679/4885SIGMAR1 628/4885MAPT 3771/4885

“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.