SCHEMBL6957321

SCHEMBL6957321

CC(C)CCN1CCC(O)CC1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 1/20 0.53
ARG1 P05089 1/20 0.40
ARG2 P78540 1/20 0.40
SPHK1 Q9NYA1 1/20 0.40
GBA1 P04062 2/20 0.39
OPRL1 P41146 1/20 0.36
TACR2 P21452 1/20 0.36
CCR5 P51681 1/20 0.35
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
NOS2 P35228 1/20 0.35
GPR119 Q8TDV5 1/20 0.35

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
SCHEMBL13519663 0.89 KCNA3 (0.43) KCNA3ARG1ARG2GBA1
SCHEMBL8085779 0.89 KCNA3 (0.43) KCNA3ARG1ARG2GBA1
SCHEMBL18233564 0.89 KCNA3 (0.43) KCNA3ARG1ARG2GBA1
SCHEMBL11932479 0.88 GBA1 (0.49) KCNA3SPHK1GBA1OPRL1
SCHEMBL21567185 0.83 KCNA3 (0.50) KCNA3SPHK1GBA1TACR2CCR5
SCHEMBL25971506 0.82 KCNA3 (0.49) KCNA3SPHK1OPRL1
SCHEMBL9322325 0.81 KCNA3 (0.41) KCNA3ARG1ARG2SPHK1GBA1
SCHEMBL8085877 0.80 CARM1 (0.52)
SCHEMBL13519612 0.80 ARG1 (0.38) KCNA3ARG1ARG2OPRL1CCR5
SCHEMBL21025208 0.79 GBA1 (0.43) KCNA3GBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11813260-B1 Benzamide compounds RECURIUM IP HOLDINGS, LLC (US) 2023-11-14 US disclosed
US-20230339865-A1 QUINAZOLINE-DERIVED HCK INHIBITORS FOR USE IN THE TREATMENT OF MYD88 MUTATED DISEASES DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-10-26 US disclosed
US-20230265092-A1 COMPOUNDS WHICH INHIBIT RNA POLYMERASE LIEBER INSTITUTE, INC. 2023-08-24 US disclosed
US-20230265092-A1 COMPOUNDS WHICH INHIBIT RNA POLYMERASE LIEBER INSTITUTE, INC. 2023-08-24 US disclosed
US-20230257390-A1 COMPOUNDS WHICH INHIBIT RNA POLYMERASE AND THEIR USE LIEBER INSTITUTE, INC. 2023-08-17 US disclosed
US-20230257390-A1 COMPOUNDS WHICH INHIBIT RNA POLYMERASE AND THEIR USE LIEBER INSTITUTE, INC. 2023-08-17 US disclosed
US-20230010358-A1 Spiro-Sulfonamide Derivatives As Inhibitors Of Myeloid Cell Leukemia-1 (MCL-1) Protein PRELUDE THERAPEUTICS, INCORPORATED 2023-01-12 US disclosed
US-11344546-B2 Benzamide compounds Recurium IP Holding, LLC (US) 2022-05-31 US disclosed
US-11318134-B2 Benzamide compounds RECURIUM IP HOLDINGS, LLC (US) 2022-05-03 US disclosed
US-11254696-B2 Dianilinopyrimidine compound for inhibiting kinase activity SHENZHEN TARGETRX, INC. (CN) 2022-02-22 US disclosed
US-20090311217-A1 3-SUBSTITUTED-1H-INDOLE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES WYETH (US) 2009-12-17 US disclosed
US-20090208557-A1 Kinase inhibitors ALLERGAN, INC. 2009-08-20 US disclosed
US-20090208557-A1 Kinase inhibitors ALLERGAN, INC. 2009-08-20 US disclosed
US-20090143414-A1 Quinazoline Derivatives Having Tyrosine Kinase Inhibitory Activity SHIONOGI & CO., LTD. (JP) 2009-06-04 US disclosed
US-20080280974-A1 Spiro compounds for treatment of inflammatory disorders CRABTREE ACQUISITION CO, LLC 2008-11-13 US disclosed
US-7393873-B2 Arylsulfonamide derivatives MERCK & CO., INC. (US) 2008-07-01 US disclosed
US-20080045526-A1 HETEROARYL DIHYDROINDOLONES AS KINASE INHIBITORS ALLERGAN, INC. 2008-02-21 US disclosed
US-20080045526-A1 HETEROARYL DIHYDROINDOLONES AS KINASE INHIBITORS ALLERGAN, INC. 2008-02-21 US disclosed
US-20070142268-A1 Antibacterial compounds having a (pyrrole carboxamide)-(benzamide)-(imidazole carboxamide) motif OSCIENT PHARMACEUTICALS CORPORATION (US) 2007-06-21 US disclosed
US-20070032478-A1 Kinase Inhibitors ALLERGAN, INC. 2007-02-08 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 (15 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-20230265092-A1 COMPOUNDS WHICH INHIBIT RNA POLYMERASE POLR2E, POLR2H, POLRMT KCNA3 3519/4885ARG1 4730/4885ARG2 4607/4885
US-11813260-B1 Benzamide compounds MKI67, TMBIM6, HDAC1 KCNA3 1827/4885ARG1 985/4885ARG2 438/4885
US-20090311217-A1 3-SUBSTITUTED-1H-INDOLE COMPOUNDS, THEIR USE AS MTOR KINASE AND PI3 KINASE INHIBITORS, AND THEIR SYNTHESES MTOR, RICTOR, PDPK1 KCNA3 2889/4885ARG1 2302/4885ARG2 3609/4885
US-20090143414-A1 Quinazoline Derivatives Having Tyrosine Kinase Inhibitory Activity ERBB2, EGFR, ABL1 KCNA3 3248/4885ARG1 828/4885ARG2 2078/4885
US-20080045526-A1 HETEROARYL DIHYDROINDOLONES AS KINASE INHIBITORS REN, JAK2, ABL1 KCNA3 2390/4885ARG1 2017/4885ARG2 1469/4885
US-11318134-B2 Benzamide compounds MKI67, TMBIM6, HDAC1 KCNA3 1827/4885ARG1 985/4885ARG2 438/4885
US-20070142268-A1 Antibacterial compounds having a (pyrrole carboxamide)-(benzamide)-(imidazole carboxamide) motif AADAC, MRPL21, HDAC6 KCNA3 1578/4885ARG1 57/4885ARG2 67/4885
US-20230257390-A1 COMPOUNDS WHICH INHIBIT RNA POLYMERASE AND THEIR USE POLR2E, POLR2H, POLRMT KCNA3 3561/4885ARG1 4772/4885ARG2 4649/4885
US-20090208557-A1 Kinase inhibitors PTK2, MAP3K6, MAP3K20 KCNA3 3942/4885ARG1 1510/4885ARG2 2117/4885
US-20080280974-A1 Spiro compounds for treatment of inflammatory disorders NR3C2, PTGER2, PTGER1 KCNA3 2356/4885ARG1 993/4885ARG2 897/4885
US-20230339865-A1 QUINAZOLINE-DERIVED HCK INHIBITORS FOR USE IN THE TREATMENT OF MYD88 MUTATED DISEASES HCK, BTK, LYN KCNA3 2930/4885ARG1 2518/4885ARG2 3183/4885
US-11344546-B2 Benzamide compounds MKI67, TMBIM6, HDAC1 KCNA3 1827/4885ARG1 985/4885ARG2 438/4885
US-11254696-B2 Dianilinopyrimidine compound for inhibiting kinase activity ALK, BRAF, MUSK KCNA3 2254/4885ARG1 4257/4885ARG2 4681/4885
US-20230010358-A1 Spiro-Sulfonamide Derivatives As Inhibitors Of Myeloid Cell Leukemia-1 (MCL-1) Protein MCL1, BCL2A1, BCL2L1 KCNA3 2945/4885ARG1 2843/4885ARG2 2447/4885
US-20070032478-A1 Kinase Inhibitors ABL1, LCK, ERBB2 KCNA3 3978/4885ARG1 4286/4885ARG2 3600/4885

“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.