SCHEMBL31662630

SCHEMBL31662630

Cc1ccc(S(=O)(=O)n2cc(C)c3c(-c4ccc5c(c4)CCN(C(=O)OC(C)(C)C)C5)cncc32)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 1/20 0.46
▸ HTR6 P50406 1/20 0.42
▸ NR1H2 P55055 2/20 0.41
▸ PDE4A P27815 1/20 0.37
▸ PDE4B Q07343 1/20 0.37
▸ PDE4C Q08493 1/20 0.37
▸ PDE4D Q08499 1/20 0.37
▸ MMP13 P45452 1/20 0.36
▸ KCNA1 Q09470 1/20 0.36
▸ KCNAB1 Q14722 1/20 0.36
▸ NAMPT P43490 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ HPGD P15428 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ KIT P10721 1/20 0.35
▸ GPR119 Q8TDV5 3/20 0.35
▸ MAPT P10636 1/20 0.35
▸ THRB P10828 1/20 0.34
▸ JAK2 O60674 1/20 0.34
▸ JAK3 P52333 1/20 0.34

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
SCHEMBL31662443 0.92 ESR2 (0.44) ESR2HTR6NR1H2PDE4APDE4B
SCHEMBL30280405 0.79 ESR2 (0.44) ESR2HTR6NR1H2MMP13KCNA1
SCHEMBL31662571 0.77 CD274 (0.39) HTR6PDE4APDE4BPDE4CPDE4D
SCHEMBL31662438 0.76 CD274 (0.41) HTR6PDE4APDE4BPDE4CPDE4D
SCHEMBL31662624 0.72 ESR2 (0.51) ESR2NR1H2NAMPTGPR119MAPT
SCHEMBL2056208 0.71 ESR2 (0.76) ESR2NR1H2NAMPTGPR119MAPT
SCHEMBL31662706 0.71 ESR2 (0.53) ESR2NR1H2NAMPTMAPT
SCHEMBL25404045 0.70 ESR2 (0.66) ESR2NR1H2NAMPTGPR119MAPT
SCHEMBL31083726 0.70 ESR2 (0.66) ESR2NR1H2NAMPTGPR119MAPT
SCHEMBL4789776 0.70 ESR2 (0.69) ESR2NR1H2GPR119

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
WO-2025151449-A1 BIFUNCTIONAL P53-BINDING COMPOUNDS AND USES THEREOF PHOTYS THERAPEUTICS, INC. (US) 2025-07-17 — — WO disclosed
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