SCHEMBL9804149

SCHEMBL9804149

Cc1cc(OCCCCCCc2c(Cl)cnn2-c2ccccc2)c2ccccc2n1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 4/20 0.38
HTR1D P28221 3/20 0.36
HTR1B P28222 3/20 0.36
GAA P10253 1/20 0.36
GRM4 Q14833 1/20 0.35
HTR1A P08908 3/20 0.35
HTR7 P34969 1/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
RAB9A P51151 1/20 0.34
KMT2A Q03164 1/20 0.34
ACP1 P24666 1/20 0.34

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
SCHEMBL9804013 0.80 NCF1 (0.40) NCF1GRM4HTR1AHTR7KDM4E
SCHEMBL9804082 0.74 BDKRB2 (0.39) NCF1HTR1DHTR1BHTR1AHTR7
SCHEMBL9804044 0.71 NCF1 (0.41) NCF1MEN1KMT2A
SCHEMBL9804032 0.71 RAB9A (0.45) GAAMAPTKDM4EMEN1NPC1
SCHEMBL16248312 0.71 NCF1 (0.51) NCF1HTR1DHTR1BHTR1ARAB9A
SCHEMBL9804045 0.70 NCF1 (0.43) NCF1ACP1
SCHEMBL9803998 0.70 MEN1 (0.46) NCF1KDM4EMEN1ALDH1A1KMT2A
SCHEMBL9804018 0.70 NCF1 (0.42) NCF1HTR1DHTR1BHTR1A
SCHEMBL16453464 0.70 NCF1 (0.49) NCF1HTR1DHTR1BHTR1AKDM4E
SCHEMBL3268831 0.70 NCF1 (0.52) NCF1KDM4EACP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5026848-A Antirhinovirus agents SYNPHAR LABORATORIES INCORPORATED (CA) 1991-06-25 US disclosed
EP-0335636-A1 Antiviral compounds SYNPHAR LABORATORIES INC. (CA) 1989-10-04 EP disclosed