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SCHEMBL14444653

SCHEMBL14444653

Cc1c(C)c2c(c(C)c1NC(=O)c1cc(C(=O)c3ccc4c(c3)C(=O)N(c3c(C)c(N5C(=O)c6ccc(C(=O)c7ccc8c(c7)C(=O)N(C)C8=O)cc6C5=O)c(C)c5c3C(C)(C)CC5)C4=O)ccc1C(=O)NCCC[Si](O)(O)O)CCC2(C)C

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PDCD1 Q15116 1/20 0.30
▸ CD274 Q9NZQ7 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL14444651 0.74 ALDH1A1 (0.37) PDCD1CD274ALDH1A1RXFP1
SCHEMBL9925317 0.67 MEN1 (0.36) PDCD1CD274ALDH1A1HTT
SCHEMBL2759722 0.62 APEX1 (0.48) ALDH1A1RXFP1
SCHEMBL9925315 0.59 MEN1 (0.40) PDCD1CD274ALDH1A1
SCHEMBL9925313 0.59 RAB9A (0.45) ALDH1A1
SCHEMBL9925318 0.59 MEN1 (0.51) ALDH1A1
SCHEMBL26799331 0.58 APEX1 (0.43) ALDH1A1RXFP1
SCHEMBL14678932 0.58 ALDH1A1 (0.46) ALDH1A1RXFP1
SCHEMBL15826863 0.57 APEX1 (0.44) ALDH1A1RXFP1
SCHEMBL10053398 0.57 ALDH1A1 (0.60) ALDH1A1RXFP1

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
US-7241491-B2 Polyimide metal laminate MITSUI CHEMICALS, INC. (JP) 2007-07-10 — — US disclosed
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