SCHEMBL28397335

SCHEMBL28397335

Clc1cc(Cl)cc(-c2c[nH]c(-c3ccccn3)n2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 1/20 0.51
CCR5 P51681 1/20 0.51
CCR8 P51685 1/20 0.51
ADORA2A P29274 1/20 0.51
ADORA1 P30542 1/20 0.51
GRM5 P41594 3/20 0.50
CBFB Q13951 4/20 0.49
METAP2 P50579 3/20 0.47
METAP1 P53582 3/20 0.47
NOTUM Q6P988 1/20 0.44
NPC1 O15118 5/20 0.43
RAB9A P51151 5/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
PKM P14618 4/20 0.43
KDM4E B2RXH2 3/20 0.43
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.43
LMNA P02545 2/20 0.43
NPY5R Q15761 1/20 0.42
MITF O75030 1/20 0.42

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
SCHEMBL17280240 0.84 SMN1; SMN2 (0.49) CCR1CCR5CCR8GRM5CBFB
SCHEMBL28406670 0.84 NOTUM (0.63) CCR1CCR5CCR8GRM5CBFB
SCHEMBL5493272 0.82 NPC1 (0.54) CCR1CCR5CCR8METAP2METAP1
SCHEMBL3136969 0.81 MAPK13 (0.49) ADORA2AADORA1SMN1; SMN2KDM4EMAPT
SCHEMBL8311607 0.80 KDM4E (0.56) CCR1CCR5CCR8CBFBMETAP2
SCHEMBL28406387 0.80 CBFB (0.47) CCR1CCR5CCR8GRM5CBFB
SCHEMBL8429326 0.80 CCR1 (0.64) CCR1CCR5CCR8ADORA2AADORA1
SCHEMBL28641255 0.79 NPY5R (0.42) ADORA2AADORA1METAP2NPC1RAB9A
SCHEMBL29712872 0.79 NPY5R (0.42) ADORA2AADORA1METAP2NPC1RAB9A
SCHEMBL28406315 0.78 CBFB (0.50) CCR1CCR5CCR8GRM5CBFB

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
CN-111057043-A Imidazole compound, preparation method and application thereof, organic weldable protective agent containing imidazole compound and surface treatment method 深圳市贝加电子材料有限公司 2020-04-24 CN claimed