SCHEMBL31417631

SCHEMBL31417631

O=C1CCC(c2c(F)cc(N3CC(CC(=O)Nc4ccc(Cl)cc4F)C3)c3c2CCO3)C(=O)N1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DDB1 Q16531 1/20 0.39
▸ CRBN Q96SW2 1/20 0.39
▸ KMT2A Q03164 1/20 0.36
▸ NPC1 O15118 2/20 0.35
▸ ALDH1A1 P00352 4/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ HPGD P15428 1/20 0.34
▸ PKM P14618 1/20 0.33
▸ RORC P51449 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ PSMD14 O00487 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.31
▸ RXFP1 Q9HBX9 2/20 0.31
▸ FPR1 P21462 1/20 0.31
▸ FPR2 P25090 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
SCHEMBL31417676 0.87 FPR1 (0.37) KMT2ANPC1RAB9AFPR1FPR2
SCHEMBL31417644 0.87 KMT2A (0.36) DDB1CRBNKMT2ANPC1ALDH1A1
SCHEMBL31417588 0.85 CRBN (0.37) DDB1CRBN
SCHEMBL31417746 0.82 PARP1 (0.33) DDB1CRBNKMT2AALDH1A1GAA
SCHEMBL31417708 0.82 PARP1 (0.33) DDB1CRBNKMT2AALDH1A1GAA
SCHEMBL31417784 0.82 PARP1 (0.33) DDB1CRBNKMT2AALDH1A1GAA
SCHEMBL31417616 0.81 CHRM2 (0.31) DDB1CRBN
SCHEMBL31417565 0.81 CHRM2 (0.31) DDB1CRBN
SCHEMBL31417806 0.81 CHRM2 (0.31) DDB1CRBN
SCHEMBL31417678 0.81 CHRM2 (0.31) DDB1CRBN

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-2025016457-A1 NEW SUBSTITUTED HETEROCYCLIC COMPOUND AS GSPTS/MYC SIGNAL FLUX REGULATOR 杭州德睿智药科技有限公司 2025-01-23 — — WO disclosed
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