SCHEMBL31496937

SCHEMBL31496937

C=C(OCC)c1cc(Br)nc(OC2CC2)c1C(=O)OC

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ OPRK1 P41145 4/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ MAOA P21397 1/20 0.32
▸ MAOB P27338 1/20 0.32
▸ ALOX15 P16050 2/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ HCRTR1 O43613 5/20 0.32
▸ HCRTR2 O43614 5/20 0.32
▸ OPRM1 P35372 1/20 0.31
▸ PDE1A P54750 1/20 0.31
▸ PDE1B Q01064 1/20 0.31
▸ PDE3B Q13370 1/20 0.31
▸ PDE1C Q14123 1/20 0.31
▸ PDE3A Q14432 1/20 0.31
▸ TP53 P04637 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
SCHEMBL31496913 0.97 MAOA (0.35) OPRK1KMT2AMAOAMAOBKDM4E
SCHEMBL31496960 0.82 HCRTR1 (0.32) OPRK1KDM4EHCRTR1HCRTR2
SCHEMBL31496984 0.82 KMT2A (0.33) KMT2AALOX15KDM4E
SCHEMBL31496873 0.81 ALDH1A1 (0.32) MAOAMAOBHCRTR1HCRTR2
SCHEMBL31261072 0.80 KMT2A (0.36) KMT2AALOX15KDM4E
SCHEMBL31496993 0.80 KDM4E (0.37) KMT2AALOX15KDM4ETP53
SCHEMBL31388128 0.79 KDM4E (0.36) KMT2AALOX15KDM4E
SCHEMBL31496920 0.78 KMT2A (0.32) OPRK1KMT2AHCRTR1HCRTR2
SCHEMBL31496970 0.77 LMNA (0.31) KMT2AMAOAMAOBHCRTR1HCRTR2
SCHEMBL30752934 0.76 KMT2A (0.34) KMT2AALOX15KDM4E

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-119585261-A PRMT5 inhibitor, preparation method and application thereof 上海艾力斯医药科技股份有限公司 2025-03-07 — — CN disclosed
Send feedback