SCHEMBL31417740

SCHEMBL31417740

O=C1CCC(c2ccc(COC(=O)Nc3cc(OC(F)(F)F)ccc3F)c3c2CCO3)C(=O)N1

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 4/20 0.37
▸ KDR P35968 3/20 0.34
▸ BRAF P15056 1/20 0.34
▸ CRBN Q96SW2 3/20 0.33
▸ SLC5A2 P31639 1/20 0.33
▸ CSNK1A1 P48729 1/20 0.33
▸ IKZF2 Q9UKS7 1/20 0.33
▸ DDB1 Q16531 2/20 0.33
▸ RIPK1 Q13546 3/20 0.32
▸ ENPP2 Q13822 5/20 0.32
▸ ATXN2 Q99700 4/20 0.32
▸ RIPK3 Q9Y572 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
SCHEMBL31417560 0.79 TRPV1 (0.32) TRPV1CRBNCSNK1A1IKZF2DDB1
SCHEMBL31417662 0.78 CRBN (0.41) TRPV1KDRCRBNCSNK1A1IKZF2
SCHEMBL31417649 0.78 CRBN (0.41) TRPV1KDRCRBNCSNK1A1IKZF2
SCHEMBL31417719 0.76 TRPV1 (0.33) TRPV1KDRBRAFCRBNCSNK1A1
SCHEMBL31417764 0.76 TRPV1 (0.33) TRPV1KDRBRAFCRBNCSNK1A1
SCHEMBL31028688 0.76 KDR (0.35) TRPV1KDRBRAFCRBNRIPK1
SCHEMBL31028638 0.76 RIPK1 (0.37) KDRBRAFCRBNRIPK1ENPP2
SCHEMBL31417643 0.75 CRBN (0.33) TRPV1KDRBRAFCRBNCSNK1A1
SCHEMBL31159045 0.75 RIPK1 (0.36) TRPV1KDRBRAFCRBNCSNK1A1
SCHEMBL31417725 0.74 TRPV1 (0.37) TRPV1CRBNCSNK1A1IKZF2DDB1

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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