SCHEMBL29904302

SCHEMBL29904302

O=C(NC1CC(CCN2CCN(c3cccc(Cl)c3Cl)CC2)C1)c1cccc2ncccc12

nearest known ligand 0.78

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 15/20 0.78
DRD3 P35462 14/20 0.78
HTR2A P28223 4/20 0.78
DRD4 P21917 3/20 0.78
HTR1A P08908 3/20 0.78
HTR2C P28335 2/20 0.78
HTR2B P41595 2/20 0.78
DRD1 P21728 1/20 0.65
HTR7 P34969 1/20 0.61
HTR6 P50406 1/20 0.61
SLC6A4 P31645 1/20 0.52

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
SCHEMBL23331418 1.00 DRD2 (0.78) DRD2DRD3HTR2ADRD4HTR1A
SCHEMBL25106927 1.00 DRD2 (0.78) DRD2DRD3HTR2ADRD4HTR1A
SCHEMBL29904305 1.00 DRD2 (0.78) DRD2DRD3HTR2ADRD4HTR1A
SCHEMBL23331609 1.00 DRD2 (0.78) DRD2DRD3HTR2ADRD4HTR1A
SCHEMBL24689902 0.92 DRD3 (0.66) DRD2DRD3HTR2ADRD4HTR1A
SCHEMBL24689483 0.92 DRD3 (0.66) DRD2DRD3HTR2ADRD4HTR1A
SCHEMBL30855313 0.87 DRD2 (1.00) DRD2DRD3HTR2ADRD4HTR1A
SCHEMBL23331419 0.86 DRD3 (0.59) DRD2DRD3HTR2ADRD4HTR1A
SCHEMBL25106803 0.85 DRD3 (0.65) DRD2DRD3HTR2ADRD4HTR1A
SCHEMBL25106664 0.82 DRD3 (0.62) DRD2DRD3HTR2ADRD4HTR1A

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12617759-B2 Modifier of four-membered ring derivative, preparation method and application thereof SHANGHAI HANSOH BIOMEDICAL CO., LTD. (CN) 2026-05-05 US disclosed
CN-118772126-A Quaternary ring derivative regulator, preparation method and application thereof 上海翰森生物医药科技有限公司 2024-10-15 CN disclosed
CN-118772125-A Quaternary ring derivative regulator, preparation method and application thereof 上海翰森生物医药科技有限公司 2024-10-15 CN disclosed
CN-113056454-B Quaternary ring derivative regulator, preparation method and application thereof 上海翰森生物医药科技有限公司 2024-08-02 CN disclosed
US-20240254109-A1 SALT CONTAINING PIPERAZINE POLYCYCLIC DERIVATIVE, CRYSTAL FORM THEREOF, PREPARATION METHOD THEREFOR, AND USE THEREOF JIANGSU HANSOH PHARMACEUTICAL GROUP CO., LTD. (CN) 2024-08-01 US disclosed
CN-117242058-A Salt containing piperazine polycyclic derivative and crystal form, and preparation method and application thereof 上海翰森生物医药科技有限公司 2023-12-15 CN disclosed
US-20230076435-A1 MODIFIER OF FOUR-MEMBERED RING DERIVATIVE, PREPARATION METHOD AND APPLICATION THEREOF SHANGHAI HANSOH BIOMEDICAL CO., LTD. (CN) 2023-03-09 US disclosed
CN-115246801-A Free base crystal form containing piperazine polycyclic derivative and preparation method and application thereof 上海翰森生物医药科技有限公司 2022-10-28 CN disclosed
EP-4053110-A1 MODIFIER OF FOUR-MEMBERED RING DERIVATIVE, PREPARATION METHOD AND APPLICATION THEREOF Shanghai Hansoh Biomedical Co., Ltd. (CN) 2022-09-07 EP 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 (3 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-20230076435-A1 MODIFIER OF FOUR-MEMBERED RING DERIVATIVE, PREPARATION METHOD AND APPLICATION THEREOF GRM4, GRM5, GRIA4 DRD2 343/4885DRD3 367/4885HTR2A 67/4885
US-20240254109-A1 SALT CONTAINING PIPERAZINE POLYCYCLIC DERIVATIVE, CRYSTAL FORM THEREOF, PREPARATION METHOD THEREFOR, AND USE THEREOF SLC6A11, GPR35, GPR132 DRD2 803/4885DRD3 1345/4885HTR2A 414/4885
US-12617759-B2 Modifier of four-membered ring derivative, preparation method and application thereof CHRNA6, HTR6, GRM6 DRD2 202/4885DRD3 204/4885HTR2A 56/4885

“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.