SCHEMBL28296234

SCHEMBL28296234

O=C(O)CCNCCCCCCCCCCCO

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.58
FFAR1 O14842 1/20 0.58
FFAR4 Q5NUL3 1/20 0.58
CAMK2A Q9UQM7 1/20 0.50
FNTA P49354 1/20 0.45
FNTB P49356 1/20 0.45
PRMT1 Q99873 1/20 0.45
ADRA1A P35348 1/20 0.42
LMNA P02545 2/20 0.42
TSHR P16473 1/20 0.42
NFKB1 P19838 1/20 0.42
PMP22 Q01453 1/20 0.42
LTA4H P09960 2/20 0.41
PAOX Q6QHF9 3/20 0.41
S1PR1 P21453 3/20 0.40
S1PR3 Q99500 2/20 0.40
S1PR5 Q9H228 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SLC22A6 Q4U2R8 1/20 0.38

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
SCHEMBL25292372 0.91 GPR84 (0.73) GPR84FFAR1FFAR4CAMK2AFNTA
SCHEMBL30792594 0.91 GPR84 (0.73) GPR84FFAR1FFAR4CAMK2AFNTA
SCHEMBL21012624 0.91 CAMK2A (0.55) GPR84FFAR1FFAR4CAMK2AFNTA
SCHEMBL2804324 0.91 PRMT1 (0.52) GPR84FFAR1FFAR4PRMT1ADRA1A
SCHEMBL12935681 0.88 PRMT1 (0.48) CAMK2APRMT1ADRA1ALMNATSHR
SCHEMBL21634383 0.86 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2AFNTA
SCHEMBL9663080 0.86 TSHR (0.60) GPR84FFAR1FFAR4PRMT1ADRA1A
SCHEMBL25178188 0.86 TSHR (0.60) GPR84FFAR1FFAR4PRMT1ADRA1A
SCHEMBL30407212 0.85 PRMT1 (0.46) CAMK2APRMT1ADRA1ALMNATSHR
Dodecanol SCHEMBL27615038 0.85 GPR84 (0.56) GPR84FFAR1FFAR4LMNATSHR

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
CN-109912528-B Peptide-like monomer, polymer thereof and application thereof 上海交通大学 2021-05-11 CN disclosed
CN-109912528-A One type peptide monomer and its polymer and application 上海交通大学 2019-06-21 CN disclosed