SCHEMBL30128211

SCHEMBL30128211

CC1(C#N)Cc2ccccc21

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39
HTR2A P28223 1/20 0.38
GAA P10253 1/20 0.37
ADRA2A P08913 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34
ADRA1B P35368 1/20 0.34

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
SCHEMBL11742012 1.00 ALDH1A1 (0.39) ALDH1A1KMT2AHTR2AGAAADRA2A
SCHEMBL12247403 0.80 SIGMAR1 (0.43) ALDH1A1
SCHEMBL15848208 0.80 CYP3A4 (0.35) ALDH1A1KMT2AHTR2AGAA
SCHEMBL779686 0.77 KDM1A (0.51) KMT2AHTR2A
SCHEMBL22367769 0.75
SCHEMBL9413028 0.71 ALDH1A1 (0.32) ALDH1A1KMT2AHTR2AGAA
SCHEMBL24146557 0.71 KIF11 (0.33) ALDH1A1KMT2AGAA
SCHEMBL548107 0.71 ALDH1A1 (0.33) ALDH1A1KMT2AHTR2AGAA
SCHEMBL29449822 0.70 HTR2A (0.45) ALDH1A1KMT2AHTR2AADRA2AADRA2B
SCHEMBL10772805 0.69 RARB (0.33) ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111542525-B Selective inhibitors of protein arginine methyltransferase 5 (PRMT 5) 普莱鲁德疗法有限公司 2023-06-27 CN claimed
US-20230174539-A1 Substituted Pyrrolo[2,3-D]Pyrimidines As Inhibitors Of Protein Arginine Methyl Transferase 5 (PRMT5) PRELUDE THERAPEUTICS INCORPORATED 2023-06-08 US claimed
CN-111542525-B Selective inhibitors of protein arginine methyltransferase 5 (PRMT 5) 普莱鲁德疗法有限公司 2023-06-27 CN disclosed
US-20230174539-A1 Substituted Pyrrolo[2,3-D]Pyrimidines As Inhibitors Of Protein Arginine Methyl Transferase 5 (PRMT5) PRELUDE THERAPEUTICS INCORPORATED 2023-06-08 US disclosed
US-11524962-B2 Substituted pyrrolo[2,3-d]pyrimidines as inhibitors of protein arginine methyl transferase 5 (PRMT5) PRELUDE THERAPEUTICS, INCORPORATED (US) 2022-12-13 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 (2 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-11524962-B2 Substituted pyrrolo[2,3-d]pyrimidines as inhibitors of protein arginine methyl transferase 5 (PRMT5) PRMT5, PRMT1, PRMT3 ALDH1A1 3040/4885KMT2A 273/4885HTR2A 4486/4885
US-20230174539-A1 Substituted Pyrrolo[2,3-D]Pyrimidines As Inhibitors Of Protein Arginine Methyl Transferase 5 (PRMT5) PRMT5, PRMT1, PRMT3 ALDH1A1 3066/4885KMT2A 279/4885HTR2A 4519/4885

“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.