SCHEMBL8899196

SCHEMBL8899196

COCCOc1ccc[n+]([O-])c1CC(=N)CO

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
ADRB2 P07550 1/20 0.31
KDM4E B2RXH2 1/20 0.30
GPR84 Q9NQS5 1/20 0.30
KDM1A O60341 1/20 0.30

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
SCHEMBL8897994 0.86 ALDH1A1 (0.33) LMNAKDM4E
SCHEMBL8897651 0.86 ALDH1A1 (0.36) LMNAKDM4E
SCHEMBL8897754 0.80
SCHEMBL8897661 0.75
SCHEMBL8895776 0.75 GPR84 (0.32) GPR84
SCHEMBL8898759 0.73 GABRA1 (0.32)
SCHEMBL8898833 0.72
SCHEMBL8895781 0.72
SCHEMBL8897883 0.72
SCHEMBL8895810 0.71

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
US-5627136-A HERBICIDES, ANTIGROWTH REGULATORS AND PLANT GROWTH REGULATORS BASF AKTIENGESELLSCHAFT (DE) 1997-05-06 US disclosed