SCHEMBL7918207

SCHEMBL7918207

C=C(OC)c1ccc2cccc(-c3ncc(C)cc3Cl)c2c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.33
KDM4E B2RXH2 2/20 0.32
CCR1 P32246 2/20 0.32
CCR5 P51681 2/20 0.32
CCR8 P51685 2/20 0.32
NPC1 O15118 2/20 0.32
MAPT P10636 2/20 0.32
RAB9A P51151 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
TP53 P04637 2/20 0.32
ALDH1A1 P00352 1/20 0.32
GLA P06280 1/20 0.32
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TTK P33981 3/20 0.32
KMT2A Q03164 2/20 0.32
PKM P14618 1/20 0.31

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
SCHEMBL7915988 0.88 HTR5A (0.39) PGK1KDM4ENPC1MAPTRAB9A
SCHEMBL16502765 0.86 TP53 (0.43) KDM4ENPC1MAPTRAB9ASMN1; SMN2
SCHEMBL7913836 0.84 KDM4E (0.36) PGK1KDM4ETTK
SCHEMBL7908662 0.82 PLA2G2D (0.40) KDM4ENPC1MAPTRAB9ASMN1; SMN2
SCHEMBL7914783 0.81 GABRG2 (0.34) KDM4ENPC1MAPTRAB9ASMN1; SMN2
SCHEMBL16502836 0.77 HTR5A (0.53) HTR5A
SCHEMBL7913827 0.76 ALOX15 (0.36) KDM4ENPC1MAPTRAB9ATP53
SCHEMBL16502675 0.76 TP53 (0.43) KDM4ENPC1MAPTRAB9ASMN1; SMN2
SCHEMBL7911006 0.75 HDAC8 (0.40) KDM4ENPC1MAPTRAB9ASMN1; SMN2
SCHEMBL16503491 0.75 HTR2A (0.39) KDM4ENPC1MAPTRAB9ASMN1; SMN2

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-2010090304-A1 ACYLGUANIDINE DERIVATIVE アステラス製薬株式会社 (JP) 2010-08-12 WO disclosed