SCHEMBL20483032

SCHEMBL20483032

COCCCOc1cc(CC2(NC=O)CCCC2)ccc1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 1/20 0.34
▸ KDM4E B2RXH2 4/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ SLC6A2 P23975 1/20 0.34
▸ SLC6A4 P31645 1/20 0.34
▸ SLC6A3 Q01959 1/20 0.34
▸ ADRA1B P35368 1/20 0.33
▸ LMNA P02545 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ MAPK1 P28482 2/20 0.33
▸ HTT P42858 1/20 0.33
▸ USP2 O75604 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ HPGD P15428 1/20 0.32
▸ ALOX12 P18054 1/20 0.32
▸ CYP2C19 P33261 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL20483174 0.98 SLC6A4 (0.36) HTR1AKDM4EMEN1KMT2ASLC6A2
SCHEMBL20482538 0.88 KDM4E (0.33) HTR1AKDM4EMEN1KMT2ASLC6A4
SCHEMBL20482446 0.85 TSHR (0.38) HTR1AKMT2ASLC6A2SLC6A4SLC6A3
SCHEMBL20482240 0.83 REN (0.41) MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL20482988 0.80 HTR1A (0.40) HTR1AKDM4EMEN1KMT2AADRA1B
SCHEMBL20482226 0.79 HPGD (0.40) HTR1AKDM4EMEN1KMT2AADRA1B
SCHEMBL20482792 0.78 REN (0.40) KMT2ALMNAHTT
SCHEMBL20482372 0.78 REN (0.40) MEN1KMT2AL3MBTL1
SCHEMBL20482542 0.77 ITGB1 (0.41) HTR1AKDM4EMEN1KMT2AALDH1A1
SCHEMBL20482585 0.76 L3MBTL1 (0.36) HTR1AMEN1KMT2ASLC6A2SLC6A4

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-2018154466-A1 DIHYDROQUINOLIZINONES AS ANTIVIRALS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-08-30 — — WO disclosed
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