SCHEMBL25512523

SCHEMBL25512523

NCCNc1cc2c(cc1F)C(=O)N(C1CCC(=O)NC1=O)C2=O

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 19/20 0.57
▸ DDB1 Q16531 12/20 0.57
▸ ALDH1A1 P00352 1/20 0.52
▸ CHRM2 P08172 1/20 0.52
▸ OPRM1 P35372 1/20 0.52
▸ IKZF3 Q9UKT9 1/20 0.52
▸ CYP1A2 P05177 1/20 0.52
▸ TSHR P16473 1/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ TNF P01375 1/20 0.48

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
SCHEMBL26755444 0.89 CRBN (0.50) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL28903628 0.88 CRBN (0.54) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL26756976 0.87 CRBN (0.53) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL20437032 0.86 CRBN (0.52) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29236864 0.86 CRBN (0.52) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29227459 0.84 CRBN (0.55) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL22565662 0.84 CRBN (0.55) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL20231165 0.84 CRBN (0.71) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL29403011 0.84 CRBN (0.71) CRBNDDB1ALDH1A1CHRM2OPRM1
SCHEMBL27404466 0.84 STAT3 (0.50) CRBNDDB1ALDH1A1CHRM2OPRM1

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-2023094833-A1 INDOLINES AS PROTAC COMPOUNDS Neophore Limited (GB) 2023-06-01 — — WO disclosed
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