SCHEMBL21863271

SCHEMBL21863271

Fc1ccc2cc[nH]c2c1I

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.59
RIPK1 Q13546 1/20 0.59
GPR84 Q9NQS5 1/20 0.39
AHR P35869 4/20 0.38
CMA1 P23946 1/20 0.33
BRD4 O60885 1/20 0.33
TAF1 P21675 1/20 0.33
BRPF1 P55201 1/20 0.33
CREBBP Q92793 1/20 0.33
CECR2 Q9BXF3 1/20 0.33
BRD9 Q9H8M2 1/20 0.33
KEAP1 Q14145 1/20 0.33
PDPK1 O15530 1/20 0.32
ACLY P53396 1/20 0.32
BACE1 P56817 1/20 0.32
PIM3 Q86V86 1/20 0.32
PTPRC P08575 1/20 0.31
PTPN2 P17706 1/20 0.31
PTPN1 P18031 1/20 0.31
PTPRB P23467 1/20 0.31

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
SCHEMBL2537028 0.77 TNF (0.63) TNFRIPK1GPR84AHRCMA1
SCHEMBL30260939 0.77 TNF (0.63) TNFRIPK1GPR84AHRCMA1
SCHEMBL31677511 0.76 TNF (0.61) TNFRIPK1GPR84AHRCMA1
SCHEMBL30548032 0.74 TNF (0.59) TNFRIPK1GPR84AHRCMA1
SCHEMBL30548029 0.74 TNF (0.59) TNFRIPK1GPR84AHRCMA1
SCHEMBL4048611 0.74 TNF (1.00) TNFRIPK1GPR84AHRCMA1
SCHEMBL6500542 0.74 TNF (0.59) TNFRIPK1GPR84AHRCMA1
SCHEMBL1420260 0.74 TNF (0.59) TNFRIPK1GPR84AHRCMA1
SCHEMBL24953856 0.74 TNF (0.39) TNFRIPK1AHRBRD4TAF1
SCHEMBL1374474 0.72 TNF (0.54) TNFRIPK1GPR84AHRCMA1

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
WO-2020065614-A1 MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2020-04-02 WO disclosed