SCHEMBL9804036

SCHEMBL9804036

Cc1cc(CCCCCCCOc2ccc3ccccc3c2)on1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
KDM4E B2RXH2 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
MAPK1 P28482 1/20 0.45
HRH3 Q9Y5N1 7/20 0.44
HDAC1 Q13547 2/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC10 Q969S8 1/20 0.44
HDAC11 Q96DB2 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
LMNA P02545 1/20 0.43

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
SCHEMBL11032320 0.86 MEN1 (0.51) MEN1KMT2ANPC1RAB9ATDP1
SCHEMBL11031570 0.82 CYP1A2 (0.46) MEN1KMT2ANPC1RAB9AKDM4E
SCHEMBL11032176 0.81 CYP1A2 (0.48) MEN1KMT2ATDP1MAPK1HRH3
SCHEMBL9804091 0.81 NPSR1 (0.50) MEN1KMT2ANPC1HRH3LMNA
SCHEMBL9804140 0.80 MAOA (0.45) MEN1KMT2AHTT
SCHEMBL9804070 0.80 MEN1 (0.51) MEN1KMT2AHRH3ALDH1A1SLC6A4
SCHEMBL9666814 0.79 CYP1A2 (0.46) MEN1KMT2AKDM4EHRH3HDAC1
SCHEMBL11034112 0.79 CYP1A2 (0.46) MEN1KMT2AKDM4EHRH3HDAC1
SCHEMBL9436179 0.79 CYP1A2 (0.46) MEN1KMT2AKDM4EHRH3HDAC1
SCHEMBL11031011 0.79 CYP1A2 (0.46) MEN1KMT2AKDM4EHRH3HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5026848-A Antirhinovirus agents SYNPHAR LABORATORIES INCORPORATED (CA) 1991-06-25 US claimed
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