SCHEMBL28100554

SCHEMBL28100554

O=CC(=O)c1c[nH]c2c(F)cccc12

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.51
MPO P05164 4/20 0.48
GUSB P08236 10/20 0.47
PCSK9 Q8NBP7 2/20 0.47
RAB9A P51151 1/20 0.45
BRPF1 P55201 1/20 0.44
SLC6A4 P31645 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
SCHEMBL2035484 0.83 GPR84 (0.53) GPR84MPOGUSBPCSK9RAB9A
SCHEMBL1559436 0.82 RAB9A (0.49) GPR84MPOGUSBPCSK9RAB9A
SCHEMBL27405878 0.80 KDM4E (0.53) BRPF1
SCHEMBL30909242 0.80 MPO (0.57) GPR84MPOGUSBPCSK9RAB9A
SCHEMBL2037236 0.77 PIM3 (0.59) GPR84MPOGUSBPCSK9RAB9A
SCHEMBL27539295 0.77 CNR2 (0.47) RAB9ABRPF1
SCHEMBL27655244 0.77 KDM4E (0.42) BRPF1
SCHEMBL2034149 0.76 NR4A2 (0.70) GPR84MPOGUSBPCSK9RAB9A
SCHEMBL27792096 0.76 PDK2 (0.41) RAB9ABRPF1
SCHEMBL2976084 0.74 CSNK2A2 (0.63) GUSBRAB9A

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-106029647-A Glucose transport inhibitors 拜耳制药股份公司 2016-10-12 CN disclosed