SCHEMBL179076

SCHEMBL179076

CCN1CCc2ccccc2C1=O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.51
NPC1 O15118 1/20 0.50
ALDH1A1 P00352 1/20 0.50
RAB9A P51151 1/20 0.50
DRD3 P35462 10/20 0.49
DRD1 P21728 4/20 0.49
DRD2 P14416 3/20 0.49
ACHE P22303 1/20 0.49
DRD4 P21917 1/20 0.48
GRM5 P41594 1/20 0.48
CYP2D6 P10635 1/20 0.46
OPRD1 P41143 1/20 0.46
KCNH2 Q12809 1/20 0.46

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
SCHEMBL29438739 1.00 HTT (0.51) HTTNPC1ALDH1A1RAB9ADRD3
SCHEMBL29322833 0.90 DRD3 (0.51) ALDH1A1DRD3DRD1DRD2DRD4
SCHEMBL21649544 0.88 DRD3 (0.51) HTTDRD3DRD1DRD2DRD4
SCHEMBL31134854 0.83 GRM5 (0.64) NPC1ALDH1A1RAB9ADRD3DRD1
SCHEMBL5811132 0.83 GRM5 (0.64) NPC1ALDH1A1RAB9ADRD3DRD1
SCHEMBL4116833 0.83 NPC1 (0.43) HTTNPC1ALDH1A1RAB9ADRD3
SCHEMBL4116828 0.83 NPC1 (0.43) HTTNPC1ALDH1A1RAB9ADRD3
SCHEMBL4552575 0.82 DRD3 (0.60) DRD3DRD1DRD2DRD4GRM5
SCHEMBL31498948 0.82 NPC1 (0.50) NPC1ALDH1A1RAB9ADRD3DRD1
SCHEMBL179103 0.81 KDM4E (0.58) HTTNPC1RAB9ADRD3DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113429344-B Preparation method of 2-ethyl-3, 4-dihydro-1 (2H) -isoquinolinone 五邑大学 2022-03-25 CN claimed
CN-113429344-A Preparation method of 2-ethyl-3, 4-dihydro-1 (2H) -isoquinolinone 五邑大学 2021-09-24 CN claimed
US-12024493-B2 Isoxazole hydroxamic acids as histone deacetylase 6 inhibitors THE GEORGE WASHINGTON UNIVERSITY, A CONGRESSIONALLY CHARTERED NOT-FOR-PROFIT CORPORATION (US) 2024-07-02 US disclosed
US-20230059865-A1 METHODS AND COMPOSITIONS FOR MODULATING SPLICING SKYHAWK THERAPEUTICS, INC. 2023-02-23 US disclosed
US-20220153709-A1 ISOXAZOLE HYDROXAMIC ACIDS AS HISTONE DEACETYLASE 6 INHIBITORS THE GEORGE WASHINGTON UNIVERSITY, A CONGRESSIONALLY CHARTERED NOT-FOR-PROFIT CORPORATION (US) 2022-05-19 US disclosed
US-11326165-B1 Methods and compositions for modulating splicing SKYHAWK THERAPEUTICS, INC. (US) 2022-05-10 US disclosed
CN-113429344-B Preparation method of 2-ethyl-3, 4-dihydro-1 (2H) -isoquinolinone 五邑大学 2022-03-25 CN disclosed
CN-113429344-B Preparation method of 2-ethyl-3, 4-dihydro-1 (2H) -isoquinolinone 五邑大学 2022-03-25 CN disclosed
CN-113429344-B Preparation method of 2-ethyl-3, 4-dihydro-1 (2H) -isoquinolinone 五邑大学 2022-03-25 CN disclosed
US-11162101-B2 Methods and compositions for modulating splicing SKYHAWK THERAPEUTICS, INC. (US) 2021-11-02 US disclosed
CN-113429344-A Preparation method of 2-ethyl-3, 4-dihydro-1 (2H) -isoquinolinone 五邑大学 2021-09-24 CN disclosed
WO-2014074365-A1 NOVEL BENZYL SULFONAMIDE COMPOUNDS USEFUL AS MOGAT-2 INHIBITORS ELI LILLY AND COMPANY (US) 2014-05-15 WO disclosed
US-8362065-B2 Carbazole carboxamide compounds useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-29 US disclosed
US-20120058996-A1 CARBAZOLE CARBOXAMIDE COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2012-03-08 US disclosed
US-8084620-B2 Carbazole carboxamide compounds useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2011-12-27 US disclosed
US-20100160303-A1 CARBAZOLE CARBOXAMIDE COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2010-06-24 US disclosed
US-20100113488-A1 MACROCYCLIC FACTOR VIIA INHIBITORS USEFUL AS ANTICOAGULANTS BRISTOL-MYERS SQUIBB COMPANY 2010-05-06 US disclosed
US-20090298812-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-12-03 US disclosed
US-7619094-B2 Ketoamides with cyclic P4's as inhibitors of NS3 serine protease of hepatitis C virus SCHERING CORPORATION (US) 2009-11-17 US disclosed
US-3961062-A Pharmaceutical composition containing 1-(imidazole-1-yl)-isoquinolines and method of treating hyperlipemia HOECHST AKTIENGESELLSCHAFT (DT) 1976-06-01 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 (9 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-20120058996-A1 CARBAZOLE CARBOXAMIDE COMPOUNDS USEFUL AS KINASE INHIBITORS BTK, FLT3, JAK1 HTT 4671/4885NPC1 3728/4885ALDH1A1 3832/4885
US-11326165-B1 Methods and compositions for modulating splicing RBM17, SF3B1, SNRPA1 HTT 640/4885NPC1 2258/4885ALDH1A1 4181/4885
US-20220153709-A1 ISOXAZOLE HYDROXAMIC ACIDS AS HISTONE DEACETYLASE 6 INHIBITORS HDAC1, HDAC7, HDAC5 HTT 1047/4885NPC1 877/4885ALDH1A1 179/4885
US-20090298812-A1 Substituted Sulfonamide Compounds BDKRB1, BDKRB2, TRPV1 HTT 3224/4885NPC1 2338/4885ALDH1A1 1980/4885
US-20100160303-A1 CARBAZOLE CARBOXAMIDE COMPOUNDS USEFUL AS KINASE INHIBITORS BTK, FLT3, JAK1 HTT 4671/4885NPC1 3728/4885ALDH1A1 3832/4885
US-12024493-B2 Isoxazole hydroxamic acids as histone deacetylase 6 inhibitors HDAC1, HDAC7, HDAC5 HTT 1047/4885NPC1 877/4885ALDH1A1 179/4885
US-20100113488-A1 MACROCYCLIC FACTOR VIIA INHIBITORS USEFUL AS ANTICOAGULANTS F12, F7, F5 HTT 4712/4885NPC1 2438/4885ALDH1A1 4067/4885
US-11162101-B2 Methods and compositions for modulating splicing RBM17, SF3B1, SNRPA1 HTT 640/4885NPC1 2258/4885ALDH1A1 4181/4885
US-20230059865-A1 METHODS AND COMPOSITIONS FOR MODULATING SPLICING RBM17, SF3B1, SNRPA1 HTT 640/4885NPC1 2258/4885ALDH1A1 4181/4885

“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.