SCHEMBL24712763

SCHEMBL24712763

O=C1CCC(N2C(=O)c3c(I)cccc3C2O)C(=O)N1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 19/20 0.47
▸ DDB1 Q16531 12/20 0.47
▸ IKZF3 Q9UKT9 3/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ CHRM2 P08172 1/20 0.47
▸ OPRM1 P35372 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ TSHR P16473 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ TNF P01375 3/20 0.45
▸ IL1B P01584 2/20 0.45
▸ IKZF1 Q13422 2/20 0.45
▸ TBXA2R P21731 1/20 0.45
▸ BRD4 O60885 1/20 0.41

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
SCHEMBL19387907 0.88 CRBN (0.59) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL21943742 0.86 CRBN (0.59) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL21207999 0.86 CRBN (0.58) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL21107417 0.86 CRBN (0.58) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL18712198 0.86 CRBN (0.59) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL23565387 0.85 CRBN (0.47) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL21896472 0.84 CRBN (0.47) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL23142992 0.83 CRBN (0.44) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL22566731 0.83 CRBN (0.44) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL20759891 0.83 CRBN (0.44) CRBNDDB1IKZF3ALDH1A1CHRM2

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-2022261627-A1 INHIBITORS OF TTBK1 THE GENERAL HOSPITAL CORPORATION (US) 2022-12-15 — — WO disclosed
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