SCHEMBL25199778

SCHEMBL25199778

CN1CC(C(=O)O)C(=O)C(C)(C)C1=O

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
ACE P12821 1/20 0.32
HTT P42858 1/20 0.32
ESR1 P03372 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL22504169 0.66 ACE (0.32) ACE
SCHEMBL21827453 0.63 MAPT (0.34) MAPT
SCHEMBL26288597 0.63 ACE (0.35) MAPTACEKMT2A
SCHEMBL16530147 0.62 GRM5 (0.36) MAPTHTTESR1MEN1KMT2A
SCHEMBL13516883 0.62 GRM5 (0.36) MAPTHTTESR1MEN1KMT2A
SCHEMBL22744724 0.60 BRD4 (0.31)
SCHEMBL6218830 0.60 MAPT (0.33) MAPTACEESR1MEN1KMT2A
SCHEMBL6999553 0.60 P2RX7 (0.40) ACEHTTMEN1KMT2A
SCHEMBL288353 0.60 P2RX7 (0.40) ACEHTTMEN1KMT2A
SCHEMBL22743989 0.60 BRD4 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4188551-A1 ARYL SUBSTITUTED PYRROLO-PYRIDINONES AND THERAPEUTIC USES THEREOF Bayer Aktiengesellschaft (DE) 2023-06-07 EP disclosed