SCHEMBL31496831

SCHEMBL31496831

O=C1c2ccccc2C(=O)N1Cc1n[nH]c(=O)c2c(OC(F)F)cc(Br)cc12

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 5/20 0.60
▸ WDR77 Q9BQA1 5/20 0.60
▸ PARP1 P09874 1/20 0.36
▸ CYP1B1 Q16678 4/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ TYR P14679 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ CASP3 P42574 1/20 0.32

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
SCHEMBL29735166 0.86 PRMT5 (0.64) PRMT5WDR77PARP1RXFP1KDM4E
SCHEMBL23087658 0.86 PRMT5 (0.64) PRMT5WDR77PARP1RXFP1KDM4E
SCHEMBL30753115 0.85 PRMT5 (0.47) PRMT5WDR77PARP1KDM4ELMNA
SCHEMBL29915065 0.84 PRMT5 (0.61) PRMT5WDR77PARP1CYP1B1RXFP1
SCHEMBL27002364 0.84 PRMT5 (0.61) PRMT5WDR77PARP1CYP1B1RXFP1
SCHEMBL29915208 0.84 PRMT5 (0.64) PRMT5WDR77PARP1CYP1B1TYR
SCHEMBL27002267 0.84 PRMT5 (0.64) PRMT5WDR77PARP1CYP1B1TYR
SCHEMBL30752851 0.83 PRMT5 (0.39) PRMT5WDR77PARP1KDM4EHSD17B10
SCHEMBL31496856 0.82 PRMT5 (0.55) PRMT5WDR77PARP1CYP1B1KDM4E
SCHEMBL29735278 0.82 PRMT5 (0.69) PRMT5WDR77PARP1CYP1B1LMNA

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
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