SCHEMBL28209243

SCHEMBL28209243

CCCCCCCCCCCCN(N)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.44
PPARG P37231 7/20 0.44
PPARD Q03181 7/20 0.44
PPARA Q07869 7/20 0.44
HDAC11 Q96DB2 5/20 0.44
TSHR P16473 4/20 0.44
PTPN1 P18031 3/20 0.44
ALDH1A1 P00352 2/20 0.44
TLR2 O60603 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
FABP4 P15090 2/20 0.44
SLC22A6 Q4U2R8 1/20 0.44
SLC22A8 Q8TCC7 1/20 0.44
MEN1 O00255 1/20 0.44
ESR1 P03372 1/20 0.44
ALOX15 P16050 1/20 0.44
PDE4A P27815 1/20 0.44
KMT2A Q03164 1/20 0.44
PDE3A Q14432 1/20 0.44
HSD17B10 Q99714 1/20 0.44

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
SCHEMBL10878603 1.00 GPR84 (0.44) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL5361611 1.00 GPR84 (0.44) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL27994448 1.00 GPR84 (0.44) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL18641586 1.00 GPR84 (0.44) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL13278947 1.00 GPR84 (0.44) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL1154654 0.98 AKR1B1 (0.42) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL454668 0.91
SCHEMBL9423516 0.88 LMNA (0.32) TSHRALDH1A1MEN1ALOX15KMT2A
SCHEMBL9423435 0.88 LMNA (0.32) TSHRALDH1A1MEN1ALOX15KMT2A
SCHEMBL31079557 0.82 DNM1 (0.42) GPR84PPARGPPARDPPARAHDAC11

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
CN-107929229-A A kind of bilayer lotion 广州市仙婷贸易有限公司 2018-04-20 CN disclosed