SCHEMBL1553739

SCHEMBL1553739

[CH2]CCN1C(=O)c2ccccc2C1=O

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GLS O94925 1/20 0.61
CASP3 P42574 2/20 0.53
RAB9A P51151 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
NPC1 O15118 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
ALDH1A1 P00352 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
MAPT P10636 1/20 0.52
CYP1A2 P05177 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C19 P33261 1/20 0.50

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
SCHEMBL1233843 0.87 TDP1 (0.58) GLSRAB9ASMN1; SMN2TDP1L3MBTL1
SCHEMBL6699936 0.85 GLS (0.71) GLSCASP3RAB9ASMN1; SMN2NPC1
SCHEMBL1553324 0.85 TDP1 (0.61) GLSRAB9ASMN1; SMN2TDP1L3MBTL1
SCHEMBL8332453 0.84 TDP1 (0.64) TDP1L3MBTL1CYP1A2CYP2C19
SCHEMBL1553659 0.84 TDP1 (0.64) TDP1L3MBTL1CYP1A2CYP2C19
SCHEMBL8324987 0.84 TDP1 (0.64) TDP1L3MBTL1CYP1A2CYP2C19
SCHEMBL8328633 0.84 TDP1 (0.64) TDP1L3MBTL1CYP1A2CYP2C19
SCHEMBL3843934 0.84 TDP1 (0.64) TDP1L3MBTL1CYP1A2CYP2C19
SCHEMBL8326959 0.82 TDP1 (0.49) GLSRAB9ASMN1; SMN2TDP1L3MBTL1
SCHEMBL6214684 0.82 TDP1 (0.49) GLSRAB9ASMN1; SMN2TDP1L3MBTL1

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 277 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110337467-B Method for preparing colorant composition and colorant composition prepared thereby 株式会社LG化学 2021-08-27 CN claimed
EP-2350090-B1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC (CA) 2015-06-03 EP claimed
US-8524781-B2 Organosulfur compounds, a method of making organosulfur compounds and their use for inhibiting the growth of tumour cells UNIVERSITY OF CAPE TOWN (ZA) 2013-09-03 US claimed
US-8263606-B2 Spiro-oxindole compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2012-09-11 US claimed
CN-102256983-A Spirooxindole compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC 2011-11-23 CN claimed
CN-102171184-A Organosulfur compounds, a method of making organosulfur compounds and their use for inhibiting the growth of tumour cells UNIV CAPE TOWN 2011-08-31 CN claimed
US-20110190368-A1 Organosulfur Compounds, a Method of Making Organosulfur Compounds and their Use for Inhibiting the Growth of Tumour Cells UNIVERSITY OF CAPE TOWN (ZA) 2011-08-04 US claimed
EP-2350090-A2 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS Xenon Pharmaceuticals Inc. (CA) 2011-08-03 EP claimed
EP-2321271-A1 ORGANOSULFUR COMPOUNDS, A METHOD OF MAKING ORGANOSULFUR COMPOUNDS AND THEIR USE FOR INHIBITING THE GROWTH OF TUMOUR CELLS University of Cape Town (ZA) 2011-05-18 EP claimed
US-20100137299-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2010-06-03 US claimed
EP-0641356-B1 INHIBITORS OF 5-ALPHA-TESTOSTERONE REDUCTASE GLAXO WELLCOME INC (US) 1998-04-22 EP claimed
US-5708001-A TESTOSTERONE-5A-REDUCTASE INHIBITORS GLAXO WELLCOME INC. (US) 1998-01-13 US claimed
WO-1997013810-A1 SULFO BENZ[e]INDOCYANINE FLUORESCENT DYES SORIN BIOMEDICA CARDIO S.P.A. (IT) 1997-04-17 WO claimed
WO-1997003783-A9 METALLOPROTEINASE INHIBITORS 1997-04-03 WO claimed
WO-1997003783-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1997-02-06 WO claimed
US-5543406-A TREATING ANDROGEN RESPONSIVE OR MEDIATED DISEASE GLAXO WELLCOME, INC. (US) 1996-08-06 US claimed
EP-0674651-A1 SUBSTITUTED 6-AZAANDROSTENONES GLAXO WELLCOME INC. (US) 1995-10-04 EP claimed
EP-0641356-A1 INHIBITORS OF 5-ALPHA-TESTOSTERONE REDUCTASE GLAXO WELLCOME INC. (US) 1995-03-08 EP claimed
WO-1994014833-A2 SUBSTITUTED 6-AZAANDROSTENONES GLAXO WELLCOME INC. (US) 1994-07-07 WO claimed
WO-1993013124-A1 INHIBITORS OF 5-ALPHA-TESTOSTERONE REDUCTASE GLAXO INC. (US) 1993-07-08 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20110190368-A1 Organosulfur Compounds, a Method of Making Organosulfur Compounds and their Use for Inhibiting the Growth of Tumour Cells OR10J3, RCOR3, CBR3 GLS 741/4885CASP3 932/4885RAB9A 836/4885
US-20100137299-A1 SPIRO-OXINDOLE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS TRPV3, TRPV1, TRPC3 GLS 1437/4885CASP3 518/4885RAB9A 1615/4885

“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.