SCHEMBL9807600

SCHEMBL9807600

CCCCCCCCCCC(O)CN(C)CCS(=O)(=O)O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 8/20 0.41
GGPS1 O95749 3/20 0.41
FFAR1 O14842 2/20 0.40
FFAR4 Q5NUL3 1/20 0.40
S1PR2 O95136 1/20 0.40
S1PR1 P21453 1/20 0.40
S1PR3 Q99500 1/20 0.40
TP53 P04637 1/20 0.39
PSMD14 O00487 2/20 0.36
PLA2G1B P04054 2/20 0.36
MMP2 P08253 2/20 0.36
ATG4B Q9Y4P1 2/20 0.36
HSP90AA1 P07900 1/20 0.36
RAD52 P43351 1/20 0.36
NFKB1 P19838 1/20 0.36

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
SCHEMBL27824241 0.98 GPR84 (0.40) GPR84GGPS1FFAR1FFAR4S1PR2
SCHEMBL11505270 0.85 GPR84 (0.43) GPR84GGPS1FFAR1FFAR4PSMD14
SCHEMBL19681508 0.81 GPR84 (0.36) GPR84GGPS1FFAR1FFAR4S1PR2
SCHEMBL8766271 0.81 USP2 (0.49) GGPS1
SCHEMBL11523164 0.81 GGPS1 (0.53) GPR84GGPS1FFAR1FFAR4S1PR2
SCHEMBL11521621 0.81 GGPS1 (0.53) GPR84GGPS1FFAR1FFAR4S1PR2
SCHEMBL11521961 0.81 GGPS1 (0.53) GPR84GGPS1FFAR1FFAR4S1PR2
SCHEMBL11523405 0.81 GGPS1 (0.53) GPR84GGPS1FFAR1FFAR4S1PR2
SCHEMBL11523729 0.81 GGPS1 (0.53) GPR84GGPS1FFAR1FFAR4S1PR2
SCHEMBL11524439 0.81 GGPS1 (0.53) GPR84GGPS1FFAR1FFAR4S1PR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2916820-B1 DELIVERY OF BIOLOGICALLY-ACTIVE AGENTS USING VOLATILE, HYDROPHOBIC SOLVENTS ROCHAL TECH LLC (US) 2023-10-11 EP claimed
EP-0256776-B1 METHOD OF COATING A SUBSTRATE BY ELECTRODEPOSITION Nippon Paint Co., Ltd. (JP) 1991-05-08 EP disclosed
US-4869796-A Electrodeposition coating composition NIPPON PAINT CO., LTD. (JP) 1989-09-26 US disclosed
EP-0256776-A2 Method of coating a substrate by electrodeposition Nippon Paint Co., Ltd. (JP) 1988-02-24 EP disclosed