SCHEMBL31324232

SCHEMBL31324232

C/C(=C\C(=O)O)c1cn[nH]c1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.37
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
TSHR P16473 1/20 0.36
AKT1 P31749 1/20 0.35
AKT2 P31751 1/20 0.35
NR4A2 P43354 2/20 0.35
NR4A1 P22736 1/20 0.35
NR4A3 Q92570 1/20 0.35
TBXAS1 P24557 3/20 0.34
FTO Q9C0B1 1/20 0.34
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
POLB P06746 1/20 0.33
HCAR2 Q8TDS4 3/20 0.32
DAO P14920 1/20 0.32
KIT P10721 1/20 0.32
KDM4E B2RXH2 2/20 0.31
MAPT P10636 2/20 0.31
USP2 O75604 1/20 0.31

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
SCHEMBL272809 0.78
SCHEMBL6155580 0.78
SCHEMBL5484621 0.72
SCHEMBL24786461 0.70
SCHEMBL13519179 0.69 TSHR (0.65) ALDH1A1KMT2AMEN1TSHRPOLB
SCHEMBL18184521 0.69 TSHR (0.42) ALDH1A1KMT2AMEN1TSHRAKT1
SCHEMBL7260327 0.68 TDP1 (0.56) ALDH1A1KMT2AMEN1NR4A2NR4A1
SCHEMBL9123801 0.68 TSHR (0.38) ALDH1A1KMT2AMEN1TSHRAKT1
SCHEMBL31324249 0.67 NR4A2 (0.42) ALDH1A1NR4A2NR4A1NR4A3TBXAS1
Oxalic Acid SCHEMBL30913890 0.66 AKT2 (0.41) ALDH1A1KMT2AMEN1TSHRAKT1

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-4734985-A1 PREVENTION, INHIBITION OR TREATMENT OF CONDITIONS OR DISORDERS MEDIATED BY UROCANATE REDUCTASE IMPLEXION PHARMA AB (SE) 2026-05-06 EP disclosed
WO-2025003469-A1 PREVENTION, INHIBITION OR TREATMENT OF CONDITIONS OR DISORDERS MEDIATED BY UROCANATE REDUCTASE IMPLEXION PHARMA AB (SE) 2025-01-02 WO disclosed