SCHEMBL9681004

SCHEMBL9681004

CN(C)c1ccc(C(=O)C(C)(C)Nc2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.53
NPC1 O15118 5/20 0.53
HPGD P15428 4/20 0.53
KCNK3 O14649 2/20 0.52
ALDH1A1 P00352 8/20 0.46
MAPT P10636 6/20 0.46
KMT2A Q03164 7/20 0.45
MEN1 O00255 6/20 0.45
KDM4E B2RXH2 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
THRB P10828 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
GAA P10253 2/20 0.44
TP53 P04637 1/20 0.44
PKM P14618 1/20 0.44
ALOX15 P16050 1/20 0.44
MAPK1 P28482 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CASP3 P42574 1/20 0.44

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
SCHEMBL9680485 0.78 ALDH1A1 (0.53) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL9314765 0.74 HPGD (0.56) RAB9ANPC1HPGDKCNK3ALDH1A1
SCHEMBL855138 0.74 ALDH1A1 (0.61) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL3638309 0.73 KCNK3 (0.82) RAB9ANPC1HPGDKCNK3ALDH1A1
SCHEMBL12260649 0.72 RAB9A (0.58) RAB9ANPC1HPGDKCNK3ALDH1A1
SCHEMBL11254993 0.72 HTT (0.44) RAB9AMAPTKMT2AMEN1KDM4E
SCHEMBL5949981 0.72 MAPT (0.59) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL194873 0.72 ALDH1A1 (0.59) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL11350456 0.72 NAPRT (0.52) RAB9ANPC1HPGDALDH1A1MAPT
SCHEMBL1646972 0.72 NAPRT (0.46) RAB9ANPC1HPGDMAPTKMT2A

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-5145885-A Morpholine compound, binders CIBA-GEIGY CORPORATION (US) 1992-09-08 US disclosed
US-4992547-A Aminoaryl ketone photoinitiators CIBA-GEIGY CORPORATION (US) 1991-02-12 US disclosed