SCHEMBL23747875

SCHEMBL23747875

Fc1cccc2cc(Cc3ccccc3Cl)c(Cl)nc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPO P05164 3/20 0.40
DRD4 P21917 1/20 0.39
DRD3 P35462 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HTT P42858 1/20 0.39
HPGD P15428 2/20 0.39
KMT2A Q03164 2/20 0.37
ALDH1A1 P00352 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
MEN1 O00255 1/20 0.36
PNP P00491 1/20 0.35
KDM4E B2RXH2 1/20 0.35
PTGES O14684 2/20 0.35
TAAR1 Q96RJ0 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
MGAM O43451 1/20 0.35

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
SCHEMBL14047371 0.78 DRD4 (0.43) DRD4DRD3L3MBTL1HPGDKMT2A
SCHEMBL18796095 0.76 KMT2A (0.64) MPOHPGDKMT2AALDH1A1NPSR1
SCHEMBL247016 0.76 DRD4 (0.38) DRD4DRD3L3MBTL1HTTKMT2A
SCHEMBL4432949 0.75 DRD4 (0.40) DRD4DRD3L3MBTL1HTTKMT2A
SCHEMBL18795962 0.73 KMT2A (0.44) MPOKMT2AKDM4ECYP1A2CYP3A4
SCHEMBL11195639 0.73 TAAR1 (0.50) L3MBTL1HTTHPGDKMT2AALDH1A1
SCHEMBL19331490 0.72 ALDH1A1 (0.40) DRD4DRD3L3MBTL1KMT2AALDH1A1
SCHEMBL18796290 0.71 KMT2A (0.44) MPOL3MBTL1HTTKMT2AKDM4E
SCHEMBL8672403 0.70 CYP1A2 (0.58) DRD4DRD3HPGDALDH1A1KDM4E
SCHEMBL12970079 0.69 MBNL1 (0.40) DRD4DRD3L3MBTL1HTTKMT2A

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
EP-3368514-B1 TRISUBSTITUTED SILYLPHENOXYHETEROCYCLES AND ANALOGUES BAYER CROPSCIENCE AG (DE) 2021-08-18 EP claimed