SCHEMBL20096534

SCHEMBL20096534

CSCCC(=O)NCCO

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
CNR1 P21554 5/20 0.44
GAA P10253 1/20 0.43
NAAA Q02083 1/20 0.42
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
MEN1 O00255 2/20 0.41
BLM P54132 2/20 0.41
KMT2A Q03164 2/20 0.41
TRPV1 Q8NER1 2/20 0.41
SELP P16109 1/20 0.41
TRPM8 Q7Z2W7 1/20 0.41
FAAH O00519 1/20 0.41
KCNK3 O14649 1/20 0.41
CNR2 P34972 1/20 0.41
HPGD P15428 2/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
ALOX12 P18054 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL14984424 0.84 CASP2 (0.47) ALDH1A1NAAACA1CA2MEN1
SCHEMBL14012179 0.84 SELP (0.51) ALDH1A1CNR1NAAAMEN1BLM
SCHEMBL12554739 0.83 CASP2 (0.55) ALDH1A1NAAACA1CA2MEN1
SCHEMBL12555034 0.83 CASP2 (0.55) ALDH1A1NAAACA1CA2MEN1
SCHEMBL7134927 0.83 CASP2 (0.45) ALDH1A1CNR1GAANAAACA1
SCHEMBL11255463 0.82 ALDH1A1 (0.43) ALDH1A1CNR1GAANAAAMEN1
SCHEMBL18712663 0.81 CASP2 (0.53) ALDH1A1NAAACA1CA2FAAH
SCHEMBL21892042 0.81 ALDH1A1 (0.43) ALDH1A1NAAACA1CA2MEN1
SCHEMBL18704618 0.81 ALDH1A1 (0.65) ALDH1A1GAACA1CA2KMT2A
SCHEMBL10036633 0.79 ALDH1A1 (0.62) ALDH1A1GAANAAACA1CA2

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
EP-3858383-A1 IMMUNE INDUCER COMPRISING ANTIGEN PEPTIDE-ADJUVANT NUCLEOTIDE CONJUGATE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME The University of Kitakyushu (JP) 2021-08-04 EP disclosed
US-20180113237-A1 AMPHIPHILIC BRANCHED POLYDIORGANOSILOXANE MACROMERS ALCON INC. (CH) 2018-04-26 US disclosed