Caprolactam

Caprolactam

SCHEMBL11839124

O=C1CCCCCN1.Oc1ccc(O)cc1

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 2/20 0.67
▸ FKBP5 Q13451 1/20 0.67
▸ OR51E2 Q9H255 1/20 0.56
▸ KDM4E B2RXH2 3/20 0.47
▸ GAA P10253 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ CTSD P07339 1/20 0.42
▸ PRKD1 Q15139 4/20 0.42
▸ KMT2A Q03164 2/20 0.38
▸ MERTK Q12866 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ PSEN1 P49768 1/20 0.36
▸ PSEN2 P49810 1/20 0.36
▸ APH1B Q8WW43 1/20 0.36
▸ NCSTN Q92542 1/20 0.36
▸ APH1A Q96BI3 1/20 0.36
▸ PSENEN Q9NZ42 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ LMNA P02545 1/20 0.36

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
Hydroquinone SCHEMBL11841825 0.91 OR51E2 (0.68) CRBNFKBP5OR51E2KDM4EGAA
Caprolactam SCHEMBL7069031 0.90 FKBP5 (0.59) CRBNFKBP5OR51E2KDM4EGAA
Caprolactam SCHEMBL28092928 0.88 FKBP5 (0.52) CRBNFKBP5OR51E2KDM4EGAA
Phenolsulfonic Acid SCHEMBL28825234 0.87 LMNA (0.53) CRBNFKBP5OR51E2KDM4EGAA
Caprolactam SCHEMBL28301539 0.84 CRBN (0.84) CRBNFKBP5OR51E2KDM4EGAA
SCHEMBL20589476 0.84 CRBN (0.94) CRBNFKBP5OR51E2KDM4EGAA
SCHEMBL20885247 0.84 CRBN (0.94) CRBNFKBP5OR51E2KDM4EGAA
SCHEMBL2515014 0.84 CRBN (0.94) CRBNFKBP5OR51E2KDM4EGAA
SCHEMBL20885246 0.84 CRBN (0.94) CRBNFKBP5OR51E2KDM4EGAA
SCHEMBL20670735 0.84 CRBN (0.94) CRBNFKBP5OR51E2KDM4EGAA

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-3988318-A HYDROXY-PHENOLS; PLASTICIZERS GAF CORPORATION (US) 1976-10-26 — — US claimed
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