SCHEMBL25923100

SCHEMBL25923100

C[C@H]1CCC(c2ccc3sc(CCCN(C)C)nc3c2)=NC1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 6/20 0.33
▸ DRD3 P35462 6/20 0.33
▸ HTR1A P08908 4/20 0.33
▸ HTR2A P28223 4/20 0.33
▸ HTR2C P28335 4/20 0.33
▸ HTR7 P34969 4/20 0.33
▸ HRH1 P35367 4/20 0.33
▸ HTR2B P41595 4/20 0.33
▸ GAA P10253 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ DRD4 P21917 2/20 0.31
▸ HDAC6 Q9UBN7 1/20 0.31
▸ ILK Q13418 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ GFER P55789 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL29081714 1.00 DRD2 (0.33) DRD2DRD3HTR1AHTR2AHTR2C
SCHEMBL30469834 1.00 DRD2 (0.33) DRD2DRD3HTR1AHTR2AHTR2C
SCHEMBL32689317 1.00 DRD2 (0.33) DRD2DRD3HTR1AHTR2AHTR2C
SCHEMBL25321028 0.94 HDAC6 (0.32) DRD2DRD3HTR1AHTR2AHTR2C
SCHEMBL24233975 0.94 HDAC6 (0.32) DRD2DRD3HTR1AHTR2AHTR2C
SCHEMBL30470700 0.94 HDAC6 (0.32) DRD2DRD3HTR1AHTR2AHTR2C
SCHEMBL30551446 0.94 HDAC6 (0.32) DRD2DRD3HTR1AHTR2AHTR2C
SCHEMBL24234044 0.89 DRD2 (0.34) DRD2DRD3HTR1AHTR2AHTR2C
SCHEMBL24366026 0.87 HDAC6 (0.32) GAAHDAC6
SCHEMBL32689101 0.87 HDAC6 (0.32) GAAHDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228478-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. 2024-07-11 — — US disclosed
CN-116568677-A piperidin-1-yl-N-pyridin-3-yl-2-oxoacetamide derivatives useful for the treatment of MTAP deficiency and/or MTA accumulating cancers 探戈医药股份有限公司 2023-08-08 — — CN disclosed
WO-2023146990-A1 COMPOUNDS AND METHODS OF USE TANGO THERAPEUTICS, INC. (US) 2023-08-03 — — WO 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-20240228478-A1 COMPOUNDS AND METHODS OF USE F12, C1R, ABCG2 DRD2 287/4885DRD3 268/4885HTR1A 937/4885

“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.

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