SCHEMBL31366797

SCHEMBL31366797

CCCCC(C(=O)O)c1ncno1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.37
MAPK1 P28482 1/20 0.37
LMNA P02545 1/20 0.35
PPARG P37231 9/20 0.35
ALOX5 P09917 8/20 0.35
PPARA Q07869 5/20 0.35
PTGES O14684 6/20 0.34
POLB P06746 1/20 0.34
SLC1A3 P43003 1/20 0.33
SLC1A2 P43004 1/20 0.33
SLC1A1 P43005 1/20 0.33
GPR84 Q9NQS5 2/20 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
SCHEMBL31366835 0.83 AKR1C3 (0.35) LMNA
SCHEMBL6607172 0.75 FAAH (0.42) CA2MAPK1LMNAPPARGALOX5
SCHEMBL27412443 0.72 AKR1C3 (0.46) CA2MAPK1POLBSLC1A3SLC1A2
SCHEMBL25469888 0.70 NR1I2 (0.33) LMNA
SCHEMBL21210721 0.70 NR1I2 (0.33) LMNA
SCHEMBL22610222 0.70 MAPK1 (0.41) CA2MAPK1PPARGALOX5PPARA
SCHEMBL6610252 0.70 MAPK1 (0.38) CA2MAPK1SLC1A3SLC1A2SLC1A1
SCHEMBL30179086 0.69 PPARA (0.42) CA2MAPK1PPARGALOX5PPARA
SCHEMBL24221538 0.66
SCHEMBL455432 0.66 POLB (0.53) MAPK1LMNAPOLB

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
CN-119486728-A Proteolysis targeting chimeric of mucosa-associated lymphoid tissue lymphoma translocation protein 1 特吉德治疗公司 2025-02-18 CN disclosed