SCHEMBL22958558

SCHEMBL22958558

CCCCC1(CCCC)c2ccccc2-c2cc3c(cc21)C/C(=N/OC(C)=O)C3=O

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ APEX1 P27695 1/20 0.36
▸ CYP2C19 P33261 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ ALDH1A1 P00352 3/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ LMNA P02545 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ TDP2 O95551 1/20 0.30
▸ MAPT P10636 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
SCHEMBL22958582 0.96 APEX1 (0.36) APEX1CYP2C19KDM4EPKMALDH1A1
SCHEMBL22958549 0.93 ALDH1A1 (0.35) CYP2C19ALDH1A1
SCHEMBL22958597 0.91 ALDH1A1 (0.34) CYP2C19ALDH1A1
SCHEMBL22958613 0.91 ALDH1A1 (0.34) CYP2C19ALDH1A1
SCHEMBL22958588 0.88 ALDH1A1 (0.35) CYP2C19ALDH1A1
SCHEMBL22958628 0.85 ALDH1A1 (0.32) ALDH1A1
SCHEMBL22958619 0.85 LMNA (0.35) ALDH1A1LMNATDP2MAPT
SCHEMBL22958600 0.82 MAPT (0.33) KDM4EALDH1A1LMNAGAAMAPT
SCHEMBL22958581 0.82 PTGS2 (0.35) CYP2C19ALDH1A1
SCHEMBL22958556 0.81 LMNA (0.35) ALDH1A1LMNATDP2MAPT

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-2021023144-A1 FLUORENOXIME ESTER COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 常州强力电子新材料股份有限公司 2021-02-11 — — WO disclosed
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