SCHEMBL28428885

SCHEMBL28428885

O=C(O)CCCCCCCN1CCN(CCCCC(=O)Nc2cccc3c2CN(C2CCC(=O)NC2=O)C3=O)CC1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAP1LC3B Q9GZQ8 7/20 0.57
▸ BRD4 O60885 7/20 0.55
▸ PTK2 Q05397 1/20 0.54
▸ CRBN Q96SW2 6/20 0.52
▸ EGFR P00533 1/20 0.52

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
SCHEMBL22464808 0.94 CRBN (0.59) MAP1LC3BBRD4CRBN
SCHEMBL29137874 0.94 CRBN (0.59) MAP1LC3BBRD4CRBN
SCHEMBL23772949 0.94 CRBN (0.59) MAP1LC3BBRD4CRBN
SCHEMBL20362334 0.94 CRBN (0.59) MAP1LC3BBRD4CRBN
SCHEMBL22464461 0.93 CRBN (0.60) MAP1LC3BBRD4CRBN
SCHEMBL464519 0.92 CRBN (0.60) MAP1LC3BBRD4CRBN
SCHEMBL26321035 0.91 CRBN (0.63) MAP1LC3BBRD4CRBN
SCHEMBL26317744 0.91 CRBN (0.63) MAP1LC3BBRD4CRBN
SCHEMBL26323874 0.91 CRBN (0.63) MAP1LC3BBRD4CRBN
SCHEMBL26323878 0.91 CRBN (0.63) MAP1LC3BBRD4CRBN

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113214227-A Heterocyclic compound and application thereof 上海青玄生物科技有限公司 2021-08-06 — — CN disclosed
CN-111285849-A Compound for targeted degradation of ALK, c-Met and ROS1 proteins and preparation method thereof 上海青东生物科技有限公司 2020-06-16 — — CN disclosed
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