SCHEMBL28089828

SCHEMBL28089828

CCCCCCCCCCCCCCCCC(O)C(=O)O.CCCCCN

nearest known ligand 0.81

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.81
FFAR1 O14842 1/20 0.81
DNM1 Q05193 4/20 0.50
MAPT P10636 1/20 0.50
GNAI3 P08754 1/20 0.50
GNAO1 P09471 1/20 0.50
GNAI1 P63096 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
LCK P06239 1/20 0.50
PPARD Q03181 1/20 0.50
ZDHHC20 Q5W0Z9 1/20 0.50
ZDHHC2 Q9UIJ5 1/20 0.50
ALDH1A1 P00352 1/20 0.50
TSHR P16473 1/20 0.50
EPHX1 P07099 1/20 0.50
GSR P00390 1/20 0.48

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
Ethylenediamine SCHEMBL11222862 0.94 GPR84 (0.84) GPR84FFAR1MAPTLCKPPARD
Ethylenediamine SCHEMBL11232097 0.94 GPR84 (0.84) GPR84FFAR1MAPTLCKPPARD
Lysine SCHEMBL27839879 0.92 GPR84 (0.68) GPR84FFAR1MAPTGNAI3GNAO1
Lysine SCHEMBL7198074 0.92 GPR84 (0.68) GPR84FFAR1MAPTGNAI3GNAO1
Monoethanolamine SCHEMBL11778579 0.91 GPR84 (0.78) GPR84FFAR1MAPTLCKPPARD
Monoethanolamine SCHEMBL7203172 0.91 GPR84 (0.78) GPR84FFAR1MAPTLCKPPARD
SCHEMBL525700 0.90 GPR84 (1.00) GPR84FFAR1MAPTLCKPPARD
SCHEMBL525377 0.90 GPR84 (1.00) GPR84FFAR1MAPTLCKPPARD
SCHEMBL22842 0.90 GPR84 (1.00) GPR84FFAR1MAPTLCKPPARD
SCHEMBL524494 0.90 GPR84 (1.00) GPR84FFAR1MAPTLCKPPARD

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-103436219-B Hot melt adhesives 汉高股份有限及两合公司 2016-08-24 CN disclosed