SCHEMBL1924337

SCHEMBL1924337

CC(C)CCNc1ccc(N)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.46
APP P05067 1/20 0.44
MAPT P10636 4/20 0.41
ADORA2A P29274 1/20 0.41
BACE1 P56817 1/20 0.40
BACE2 Q9Y5Z0 1/20 0.40
ADRA2A P08913 1/20 0.39
CYP1A2 P05177 3/20 0.38
ALOX12 P18054 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2C19 P33261 2/20 0.38
LMNA P02545 1/20 0.38
CYP2C8 P10632 1/20 0.38
CYP2B6 P20813 1/20 0.38
GAA P10253 1/20 0.38
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
CA12 O43570 2/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 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
SCHEMBL25443755 0.89 MAPT (0.50) MAPTADORA2ABACE1BACE2ADRA2A
SCHEMBL9494550 0.88 TDP1 (0.43) TDP1APPMAPTGAAMAOA
SCHEMBL14253823 0.88 APP (0.44) TDP1APPMAPTCYP1A2ALOX12
SCHEMBL28621183 0.86 PRSS1 (0.42) TDP1APPMAPTADORA2AGAA
SCHEMBL28657195 0.85 PRSS1 (0.43) TDP1APPMAPTALDH1A1
SCHEMBL11472557 0.84 APP (0.42) TDP1APPMAPTCYP1A2ALOX12
SCHEMBL21799587 0.82 APP (0.41) TDP1APPMAPTGAAMAOA
SCHEMBL14594024 0.81 APP (0.46) APPMAPTCYP1A2ALOX12CYP2C9
SCHEMBL183639 0.81 MAPT (0.67) MAPTADORA2AADRA2AALOX12LMNA
SCHEMBL26000374 0.81 MEN1 (0.47) MAPTADORA2ABACE1BACE2ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111971119-B Heterogeneous catalyst for carbamate synthesis 科思创知识产权两合公司 2023-12-08 CN claimed
US-11406964-B2 Heterogeneous catalysts for the synthesis of carbamates COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2022-08-09 US claimed
CN-110650944-B Silica-based zinc catalysts, their preparation and use in the alkoxycarbonylation of amines 科思创德国股份有限公司 2022-07-19 CN claimed
EP-3625210-B1 SILICA-BASED ZINC CATALYSTS. THEIR PREPARATION AND USE IN THE ALKOXYCARBONYLATION OF AMINES COVESTRO INTELLECTUAL PROPERTY GMBH & CO KG (DE) 2021-06-23 EP claimed
US-20210053031-A1 HETEROGENEOUS CATALYSTS FOR THE SYNTHESIS OF CARBAMATES COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2021-02-25 US claimed
CN-105229015-B Zinc cluster compounds and their use as catalysts in the reaction of amines with dialkyl carbonates 科思创德国股份公司 2020-11-03 CN claimed
US-10807084-B2 Silica-based zinc catalysts, their preparation and use in the alkoxycarbonylation of amines COVESTRO DEUTSCHLAND AG (DE) 2020-10-20 US claimed
US-20200147594-A1 SILICA-BASED ZINC CATALYSTS, THEIR PREPARATION AND USE IN THE ALKOXYCARBONYLATION OF AMINES COVESTRO DEUTSCHLAND AG (DE) 2020-05-14 US claimed
EP-3625210-A1 SILICA-BASED ZINC CATALYSTS. THEIR PREPARATION AND USE IN THE ALKOXYCARBONYLATION OF AMINES Covestro Deutschland AG (DE) 2020-03-25 EP claimed
CN-110650944-A Silica-based zinc catalysts, their preparation and use in the alkoxycarbonylation of amines 科思创德国股份有限公司 2020-01-03 CN claimed
US-20160194277-A1 ZINC CLUSTER COMPOUNDS AND THEIR USE AS CATALYSTS IN THE REACTION OF AMINES WITH DIALKYL CARBONATES COVESTRO DEUTSCHLAND AG (DE) 2016-07-07 US claimed
EP-2999705-A1 ZINC CLUSTER COMPOUNDS AND THEIR USE AS CATALYSTS IN THE REACTION OF AMINES WITH DIALKYL CARBONATES Covestro Deutschland AG (DE) 2016-03-30 EP claimed
US-9278906-B2 Process for hydrogenating aromatic di- and polyamines to cycloaliphatic di- and polyamines BAYER MATERIALSCIENCE AG (DE) 2016-03-08 US claimed
CN-105229015-A Zinc cluster compounds and their use as catalysts in the reaction of amines with dialkyl carbonates BAYER MATERIALSCIENCE AG 2016-01-06 CN claimed
EP-2905273-A1 Process for hydrogenating aromatic di- and polyamines Bayer MaterialScience AG (DE) 2015-08-12 EP claimed
EP-2905272-A1 Process for hydrogenating aromatic di- and polyamines to cycloaliphatic di- and polyamines Bayer MaterialScience AG (DE) 2015-08-12 EP claimed
US-20150218082-A1 PROCESS FOR HYDROGENATING AROMATIC DI- AND POLYAMINES COVESTRO DEUTSCHLAND AG (DE) 2015-08-06 US claimed
US-20150218083-A1 PROCESS FOR HYDROGENATING AROMATIC DI- AND POLYAMINES TO CYCLOALIPHATIC DI- AND POLYAMINES COVESTRO DEUTSCHLAND AG (DE) 2015-08-06 US claimed
CN-104817460-A Process for hydrogenating aromatic di- and polyamines BAYER MATERIALSCIENCE AG 2015-08-05 CN claimed
CN-104817459-A Process for hydrogenating aromatic di- and polyamines to cycloaliphatic di- and polyamines BAYER MATERIALSCIENCE AG 2015-08-05 CN 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 (7 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-20200147594-A1 SILICA-BASED ZINC CATALYSTS, THEIR PREPARATION AND USE IN THE ALKOXYCARBONYLATION OF AMINES CDYL, ZYX, CXXC4 TDP1 4407/4885APP 2694/4885MAPT 3375/4885
US-20150218083-A1 PROCESS FOR HYDROGENATING AROMATIC DI- AND POLYAMINES TO CYCLOALIPHATIC DI- AND POLYAMINES DDT, HRH3, HRH4 TDP1 2325/4885APP 2745/4885MAPT 2582/4885
US-20210053031-A1 HETEROGENEOUS CATALYSTS FOR THE SYNTHESIS OF CARBAMATES SCO2, CDYL, PYM1 TDP1 2099/4885APP 4125/4885MAPT 1340/4885
US-11406964-B2 Heterogeneous catalysts for the synthesis of carbamates SCO2, CDYL, PYM1 TDP1 2099/4885APP 4125/4885MAPT 1340/4885
US-20150218082-A1 PROCESS FOR HYDROGENATING AROMATIC DI- AND POLYAMINES HNMT, DDT, HRH3 TDP1 2534/4885APP 3332/4885MAPT 3358/4885
US-20160194277-A1 ZINC CLUSTER COMPOUNDS AND THEIR USE AS CATALYSTS IN THE REACTION OF AMINES WITH DIALKYL CARBONATES AOC1, AOC2, ODC1 TDP1 4060/4885APP 3323/4885MAPT 4142/4885
US-10807084-B2 Silica-based zinc catalysts, their preparation and use in the alkoxycarbonylation of amines CDYL, ZYX, CXXC4 TDP1 4407/4885APP 2694/4885MAPT 3375/4885

“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.