SCHEMBL18790600

SCHEMBL18790600

c1ccc(-c2cc(-c3cccc(C4CCCCC4)c3)ccn2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMO O15229 1/20 0.48
ASIC3 Q9UHC3 1/20 0.42
PIM1 P11309 1/20 0.42
CYP11B2 P19099 1/20 0.41
CTSS P25774 1/20 0.40
CTSK P43235 1/20 0.40
USP30 Q70CQ3 2/20 0.40
DHODH Q02127 1/20 0.40
ADORA1 P30542 2/20 0.39
ADORA3 P0DMS8 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA2B P29275 1/20 0.39
POLB P06746 2/20 0.39
CASP3 P42574 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
PRKDC P78527 1/20 0.39
RAF1 P04049 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC2 Q92769 1/20 0.39

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
SCHEMBL18790857 0.98 KMO (0.45) KMOASIC3PIM1CYP11B2CTSS
SCHEMBL18790607 0.92 KMO (0.40) KMOASIC3PIM1CTSSCTSK
SCHEMBL18790599 0.88 DHODH (0.48) ASIC3PIM1CYP11B2USP30DHODH
SCHEMBL18790856 0.87 DHODH (0.46) ASIC3PIM1USP30DHODHADORA1
SCHEMBL18729702 0.86 ASIC3 (0.49) KMOASIC3PIM1CYP11B2USP30
SCHEMBL18790589 0.86 ASIC3 (0.41) ASIC3PIM1CTSSCTSKUSP30
SCHEMBL22134616 0.85 KMO (0.44) KMOASIC3CYP11B2CTSSCTSK
SCHEMBL18790498 0.85 ASIC3 (0.40) ASIC3PIM1CTSSCTSKUSP30
SCHEMBL18643803 0.84 S1PR1 (0.44) KMOCYP11B2CTSSCTSKADORA1
SCHEMBL18790535 0.83 ASIC3 (0.39) ASIC3PIM1CTSSCTSKUSP30

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
EP-3159350-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2017-04-26 EP disclosed