SCHEMBL9066832

SCHEMBL9066832

CC(C)(c1ccc(N)cc1)N(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.48
ALDH1A1 P00352 5/20 0.48
CYP3A4 P08684 5/20 0.48
TDP1 Q9NUW8 4/20 0.48
L3MBTL1 Q9Y468 3/20 0.48
CYP1A2 P05177 2/20 0.48
CYP2C9 P11712 2/20 0.48
CYP2C19 P33261 2/20 0.48
CYP2D6 P10635 2/20 0.48
KDM4E B2RXH2 1/20 0.48
TSHR P16473 2/20 0.39
MAPK1 P28482 3/20 0.38
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
HPGD P15428 1/20 0.38
TAAR1 Q96RJ0 2/20 0.38
HSD17B10 Q99714 1/20 0.38
TP53 P04637 1/20 0.37
ALOX15 P16050 1/20 0.37
MAOA P21397 4/20 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
SCHEMBL28364629 0.96 MAPT (0.48) MAPTALDH1A1CYP3A4TDP1L3MBTL1
SCHEMBL2038162 0.85 KCNN4 (0.42) MAPTALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL20629502 0.83 RAB9A (0.45) MAPTALDH1A1CYP3A4TDP1L3MBTL1
SCHEMBL8061599 0.83 KCNN4 (0.41) MAPTALDH1A1CYP3A4CYP2C9CYP2C19
SCHEMBL811385 0.80 ESR1 (0.50) ALDH1A1CYP3A4KDM4ETSHRMAPK1
SCHEMBL8745890 0.79 CYP3A4 (0.58) MAPTALDH1A1CYP3A4TDP1L3MBTL1
SCHEMBL16863748 0.78 MAPT (0.42) MAPTALDH1A1CYP3A4TDP1L3MBTL1
SCHEMBL19774510 0.77 L3MBTL1 (0.41) MAPTALDH1A1CYP3A4TDP1L3MBTL1
SCHEMBL21208371 0.77 CYP2D6 (0.35) ALDH1A1CYP3A4CYP2C9CYP2C19CYP2D6
SCHEMBL19440984 0.77 ALDH1A1 (0.42) MAPTALDH1A1CYP3A4TDP1L3MBTL1

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
EP-0326223-B1 Copolymer composition SHELL INT RESEARCH (NL) 1996-05-08 EP disclosed
EP-0326223-A2 Copolymer composition SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1989-08-02 EP disclosed