SCHEMBL27306363

SCHEMBL27306363

CCC1CC(C)(CC)Nc2ccc(Nc3ccccc3)c(C)c21

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PKM P14618 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ ALOX12 P18054 1/20 0.36
▸ RAD52 P43351 1/20 0.36
▸ GFER P55789 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ GAA P10253 1/20 0.32
▸ MGAT1 P26572 1/20 0.32
▸ MGAT3 Q09327 1/20 0.32
▸ MGAT2 Q10469 1/20 0.32
▸ PARP14 Q460N5 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
SCHEMBL27306368 0.79 GAA (0.36) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL27306927 0.75 MEN1 (0.32) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL27306360 0.71 MEN1 (0.35) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL10718787 0.69 HTR5A (0.36) KMT2AALDH1A1MAPT
SCHEMBL27306243 0.68 MEN1 (0.34) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL27306472 0.68 MEN1 (0.34) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL27306926 0.67 MGAT2 (0.35) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL27306480 0.66 MEN1 (0.33) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL27306362 0.65 PGR (0.31) GAAMGAT1MGAT3MGAT2
SCHEMBL26816408 0.63 KDM4E (0.36) KMT2AMEN1ALDH1A1MAPTL3MBTL1

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-2023235855-A1 QUINOLINEAMINE ANTIDEGRADANT COMPOUNDS AND USES THEREOF FLEXSYS AMERICA L.P. (US) 2023-12-07 — — WO disclosed
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