SCHEMBL4631245

SCHEMBL4631245

CN(C)CC1CCCC1=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 3/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CCR6 P51684 1/20 0.39
PTGS1 P23219 2/20 0.37
PTGS2 P35354 2/20 0.37
OPRK1 P41145 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
METAP1 P53582 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
MITF O75030 1/20 0.36
HSP90AA1 P07900 1/20 0.36

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
SCHEMBL6865770 1.00 HTR6 (0.39) HTR6NPC1LMNARAB9ASMN1; SMN2
SCHEMBL3146259 0.94 CA1 (0.45) NPC1RAB9ASMN1; SMN2CCR6PTGS1
SCHEMBL6865388 0.94 CA1 (0.45) NPC1RAB9ASMN1; SMN2CCR6PTGS1
Hydrochloric Acid SCHEMBL3120247 0.92 CA1 (0.43) NPC1RAB9ASMN1; SMN2CCR6KMT2A
SCHEMBL4631229 0.92 KMT2A (0.47) NPC1RAB9ASMN1; SMN2CCR6PTGS1
Hydrochloric Acid SCHEMBL28863686 0.92 CA1 (0.43) NPC1RAB9ASMN1; SMN2CCR6KMT2A
SCHEMBL14228794 0.92 KMT2A (0.47) NPC1RAB9ASMN1; SMN2CCR6PTGS1
SCHEMBL4631860 0.92 KMT2A (0.47) NPC1RAB9ASMN1; SMN2CCR6PTGS1
SCHEMBL13899831 0.86
SCHEMBL13948191 0.80 CA1 (0.41) NPC1LMNARAB9ASMN1; SMN2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11209421-B2 Cytidine deaminase expression level in cancer as a new therapeutic target CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2021-12-28 US disclosed
US-20190293629-A1 CYTIDINE DEAMINASE EXPRESSION LEVEL IN CANCER AS A NEW THERAPEUTIC TARGET CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2019-09-26 US disclosed
US-8791288-B2 Acid-labile ester monomer having spirocyclic structure, polymer, resist composition, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-07-29 US disclosed
US-8791288-B2 Acid-labile ester monomer having spirocyclic structure, polymer, resist composition, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-07-29 US disclosed
CN-101168530-B 1,4-dioxoquinoxaline formaldehyde dihydrazone with weed control activity and its preparation method and application UNIV HUAZHONG AGRICULTURAL 2011-02-09 CN disclosed
US-20100304295-A1 ACID-LABILE ESTER MONOMER HAVING SPIROCYCLIC STRUCTURE, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2010-12-02 US disclosed
US-20100304295-A1 ACID-LABILE ESTER MONOMER HAVING SPIROCYCLIC STRUCTURE, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2010-12-02 US disclosed
EP-1768948-B1 SUBSTITUTED AMINO COMPOUNDS AS 5-HT/NA UPTAKE INHIBITORS GRUENENTHAL GMBH (DE) 2008-05-21 EP disclosed
CN-101168530-A 1,4-dioxoquinoxaline formaldehyde dihydrazone with weed control activity and its preparation method and application UNIV HUAZHONG AGRICULTURAL (CN) 2008-04-30 CN disclosed
US-7342133-B2 Substituted amino compounds as 5-HT/NA uptake inhibitors GRUENENTHAL GMBH (DE) 2008-03-11 US disclosed
EP-1069106-A2 Dimethyl-(3-aryl-but-3-enyl) amine derivatives with analgesic activity Grünenthal GmbH (DE) 2001-01-17 EP disclosed
EP-0983994-A2 Pharmaceutically-active dimethyl-(3-aryl-but-3-enyl)-amine compounds Grünenthal GmbH (DE) 2000-03-08 EP disclosed
US-5811582-A ANALGESICS GRUENENTHAL GMBH (DE) 1998-09-22 US disclosed
CN-1163884-A Dimethyl-(3-aryl-but-3-enyl)-amine compounds as pharmaceutical active ingredients GRUENENTHAL GMBH (DE) 1997-11-05 CN disclosed
EP-0799819-A1 Dimethyl-(3-aryl-but-3-enyl) amine derivatives with analgesic activity Grünenthal GmbH (DE) 1997-10-08 EP disclosed
EP-0077536-B1 2'-SUBSTITUTED-SPIRO(BENZOFURAN-2(3H),1'-CYCLOALKANES), A PROCESS FOR PREPARING SAME, PHARMACEUTICAL COMPOSITIONS CONTAINING SUCH COMPOUNDS AND THEIR USE AS MEDICAMENTS HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1986-07-16 EP disclosed
US-4594435-A ANTIDEPRESSANTS; ANALGESICS HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1986-06-10 US disclosed
US-4517311-A 2'-Substituted-spiro[benzofuran-2(3H),1'-cycloalkanes] and their analgesic and anti-depressant compositions HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1985-05-14 US disclosed
EP-0077536-A2 2'-Substituted-spiro(benzofuran-2(3H),1'-cycloalkanes), a process for preparing same, pharmaceutical compositions containing such compounds and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1983-04-27 EP disclosed
US-4011226-A ANTIULCER JOHN WYETH & BROTHER LIMITED (EN) 1977-03-08 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-20100304295-A1 ACID-LABILE ESTER MONOMER HAVING SPIROCYCLIC STRUCTURE, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS COASY, DHCR24, HCAR1 HTR6 4338/4885NPC1 2327/4885LMNA 922/4885

“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.