SCHEMBL23924446

SCHEMBL23924446

CC(C)C1CN(C)CC1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.36
▸ SLC1A2 P43004 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ GABRR1 P24046 1/20 0.34
▸ POLB P06746 1/20 0.33

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
SCHEMBL23924445 1.00 MAPT (0.36) MAPTSLC1A2MEN1CYP1A2ALOX15
SCHEMBL19080639 0.79 GABRR1 (0.46) MAPTMEN1KMT2AGABRR1
SCHEMBL7826374 0.79 GABRR1 (0.46) MAPTMEN1KMT2AGABRR1
SCHEMBL788723 0.74 — —
SCHEMBL12201130 0.71 GABRR1 (0.50) KMT2AGABRR1
SCHEMBL21776710 0.71 GABRR1 (0.39) MEN1KMT2AGABRR1
SCHEMBL17972972 0.71 GABRR1 (0.39) KMT2AGABRR1
SCHEMBL13404483 0.71 GABRR1 (0.39) MEN1KMT2AGABRR1
SCHEMBL19655789 0.71 GABRR1 (0.39) MEN1KMT2AGABRR1
SCHEMBL12763445 0.70 SLC1A2 (0.48) SLC1A2MEN1CYP1A2ALOX15KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3844159-B1 NOVEL PYRROLIDINYL AMIDE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE HOFFMANN LA ROCHE (CH) 2023-05-03 — — EP disclosed
US-20210323977-A1 PYRROLIDINYL AMIDE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE HOFFMANN-LA ROCHE INC. (US) 2021-10-21 — — 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 (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-20210323977-A1 PYRROLIDINYL AMIDE COMPOUNDS FOR THE TREATMENT OF AUTOIMMUNE DISEASE ARG1, SSB, ARG2 MAPT 3489/4885SLC1A2 1635/4885MEN1 464/4885

“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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