SCHEMBL27305895

SCHEMBL27305895

COc1cc(Nc2ccccc2)cc2c1NC(C)(C)CC2C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 5/20 0.39
▸ MEN1 O00255 5/20 0.39
▸ KMT2A Q03164 5/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ MAPT P10636 2/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ RAD52 P43351 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ BRAF P15056 1/20 0.36
▸ NR3C1 P04150 2/20 0.35
▸ STK10 O94804 1/20 0.35
▸ SLK Q9H2G2 1/20 0.35
▸ AR P10275 6/20 0.35
▸ NR3C2 P08235 1/20 0.35
▸ PDGFRB P09619 1/20 0.34
▸ PDGFRA P16234 1/20 0.34

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
SCHEMBL27305821 0.84 ALDH1A1 (0.42) PGRMEN1KMT2AALDH1A1MAPT
SCHEMBL30663275 0.84 ALDH1A1 (0.42) PGRMEN1KMT2AALDH1A1MAPT
SCHEMBL27305900 0.82 ALDH1A1 (0.41) PGRMEN1KMT2AALDH1A1MAPT
SCHEMBL27305904 0.81 ALDH1A1 (0.39) PGRMEN1KMT2AALDH1A1MAPT
SCHEMBL27305995 0.80 AR (0.35) PGRALDH1A1MAPTNR3C1AR
SCHEMBL27306011 0.76 AR (0.33) PGRALDH1A1L3MBTL1ALOX15NR3C1
SCHEMBL27306356 0.76 MEN1 (0.33) MEN1KMT2AALDH1A1MAPTL3MBTL1
SCHEMBL30973148 0.76 ALDH1A1 (0.53) PGRMEN1KMT2AALDH1A1MAPT
SCHEMBL27306825 0.75 BRAF (0.34) MEN1KMT2AMAPTRAD52BRAF
SCHEMBL10716481 0.74 HTR2C (0.46) PGRMEN1KMT2AALDH1A1MAPT

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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