SCHEMBL8635706

SCHEMBL8635706

COCC(O)CN(Cc1ccc(C)o1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
ALDH1A1 P00352 2/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
POLB P06746 1/20 0.39
ALOX5 P09917 1/20 0.37
THRB P10828 2/20 0.36
MAPK1 P28482 1/20 0.36
TP53 P04637 1/20 0.35
AR P10275 1/20 0.34
CETP P11597 1/20 0.33

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
SCHEMBL8630284 0.90 POLB (0.39) MAPTALDH1A1PKMHPGDTSHR
SCHEMBL8629617 0.88 ALDH1A1 (0.41) MAPTALDH1A1PKMHPGDTSHR
SCHEMBL8636072 0.85 ALOX5 (0.39) MAPTALDH1A1PKMHPGDTSHR
SCHEMBL8748380 0.85 POLB (0.38) MAPTALDH1A1PKMHPGDTSHR
SCHEMBL8632233 0.82 CETP (0.39) ALDH1A1PKMTSHRPOLBALOX5
SCHEMBL8632586 0.80 POLB (0.35) MAPTALDH1A1PKMHPGDTSHR
SCHEMBL8632559 0.79 POLB (0.50) MAPTALDH1A1PKMHPGDTSHR
SCHEMBL1059031 0.76 MAPT (0.46) MAPTALDH1A1TSHRPOLB
SCHEMBL8633566 0.74 TSHR (0.55) MAPTALDH1A1PKMHPGDTSHR
SCHEMBL8632445 0.74 POLB (0.46) MAPTALDH1A1PKMHPGDTSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5709816-A N,N-DISUBSTITUTED ANILINE COMPOUNDS KAO CORPORATION (JP) 1998-01-20 US disclosed
EP-0761214-A2 N,N-disubstituted anilines or alkylamines as singlet oxygen quenchers, topical compositions comprising them KAO CORPORATION (JP) 1997-03-12 EP disclosed