SCHEMBL27306239

SCHEMBL27306239

CCC1=CC(C)(CC)Nc2c(CC)cc(Nc3ccccc3)cc21

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.35
▸ MAPT P10636 4/20 0.32
▸ LMNA P02545 2/20 0.32
▸ MAPK1 P28482 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ RGS12 O14924 1/20 0.32
▸ GMNN O75496 1/20 0.32
▸ PRKD3 O94806 1/20 0.32
▸ EGFR P00533 1/20 0.32
▸ PRKCG P05129 1/20 0.32
▸ PRKCB P05771 1/20 0.32
▸ GLA P06280 1/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ SRC P12931 1/20 0.32
▸ PRKCA P17252 1/20 0.32
▸ NFKB1 P19838 1/20 0.32
▸ PRKCH P24723 1/20 0.32

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
SCHEMBL27306358 0.88 APP (0.32) APPMAPTLMNAMAPK1HPGD
SCHEMBL27306369 0.87 APP (0.32) APP
SCHEMBL27306478 0.85 APP (0.30) APP
SCHEMBL27306242 0.85 STK10 (0.36) APPMAPTMAPK1HPGDMEN1
SCHEMBL27306728 0.83 ALDH1A1 (0.33) MAPTALDH1A1MEN1EGFRCYP3A4
SCHEMBL27306615 0.78 ALDH1A1 (0.34) ALDH1A1CYP3A4SMN1; SMN2TDP1HSD17B10
SCHEMBL27306727 0.76 — —
SCHEMBL27306365 0.72 EGFR (0.37) MAPTLMNAMAPK1ALDH1A1HPGD
SCHEMBL27306481 0.68 — —
SCHEMBL27306822 0.68 MAPT (0.31) MAPTLMNAMAPK1ALDH1A1KDM4E

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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