SCHEMBL8555468

SCHEMBL8555468

Cc1cc(-c2nnn(C)n2)cc(C)c1OCCCC(O)c1nccn1C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.33
KMT2A Q03164 3/20 0.32
MEN1 O00255 2/20 0.32
LMNA P02545 2/20 0.32
ALOX15 P16050 2/20 0.32
USP2 O75604 1/20 0.32
MAPK1 P28482 1/20 0.32
KDM4E B2RXH2 2/20 0.32
CYP2D6 P10635 1/20 0.31
MAPT P10636 2/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
PKM P14618 1/20 0.31
TSHR P16473 1/20 0.31
ALOX12 P18054 1/20 0.31
HSD17B10 Q99714 1/20 0.31
NPC1 O15118 1/20 0.30
NFKB1 P19838 1/20 0.30
RAB9A P51151 1/20 0.30
NFKB2 Q00653 1/20 0.30

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
SCHEMBL8552583 0.80 USP2 (0.33) KMT2AUSP2KDM4ECYP2D6MAPT
SCHEMBL8557109 0.79 KMT2A (0.36) KMT2AMEN1LMNAALOX15USP2
SCHEMBL9090421 0.79 KMT2A (0.43) KMT2AMEN1LMNAALOX15USP2
SCHEMBL8557108 0.79 L3MBTL1 (0.31) L3MBTL1NPC1NFKB1RAB9ANFKB2
SCHEMBL8553780 0.75 NPC1 (0.36) KMT2AMEN1LMNAALOX15USP2
SCHEMBL8555533 0.75 KMT2A (0.32) KMT2AMEN1LMNAALOX15USP2
SCHEMBL8555548 0.75 LMNA (0.40) KMT2ALMNAMAPTNPC1NFKB1
SCHEMBL8665035 0.75 RIPK1 (0.34) USP2KDM4EMAPTALDH1A1GAA
SCHEMBL8603712 0.74 NR1I2 (0.37) L3MBTL1KMT2AMEN1LMNAALOX15
SCHEMBL8604570 0.74 HDAC6 (0.38) KMT2AMEN1ALDH1A1NPC1NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5846986-A Therapeutic phenoxyalkylazoles and phenoxyalkylazines SANOFI (FR) 1998-12-08 US disclosed
US-5721261-A TREATING PICORNAVIRUS INFECTIONS SANOFI PHARMACEUTICALS, INC. (US) 1998-02-24 US disclosed
US-5552420-A TREATING PICORNAVIRAL INFECTIONS STERLING WINTHROP INC. (US) 1996-09-03 US disclosed
WO-1995031452-A1 THERAPEUTIC PHENOXYALKYLAZOLES AND PHENOXYALKYLAZINES SANOFI WINTHROP, INC. (US) 1995-11-23 WO disclosed