SCHEMBL11265817

SCHEMBL11265817

Cc1ccc(Cl)c(OCC2=NCCN2)c1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 11/20 0.58
ADRA1A P35348 9/20 0.57
ADRA1D P25100 3/20 0.57
ADRA1B P35368 3/20 0.57
HTR1A P08908 4/20 0.51
ADRA2A P08913 4/20 0.51
ADRA2B P18089 4/20 0.51
ADRA2C P18825 4/20 0.51
MAOA P21397 2/20 0.49
MAOB P27338 2/20 0.49
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
THRB P10828 1/20 0.48
TSHR P16473 1/20 0.48
CYP2C19 P33261 1/20 0.48
THPO P40225 1/20 0.48
HSD17B10 Q99714 1/20 0.48

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
SCHEMBL14060988 0.86 NISCH (0.54) NISCHADRA1AADRA1DADRA1BHTR1A
Tymazoline SCHEMBL250491 0.81 NISCH (0.70) NISCHADRA1AADRA1DADRA1BHTR1A
SCHEMBL11256297 0.81 ADRA1A (0.58) NISCHADRA1AADRA1DADRA1BHTR1A
Tymazoline SCHEMBL29387735 0.81 NISCH (0.70) NISCHADRA1AADRA1DADRA1BHTR1A
Cilutazoline SCHEMBL2108875 0.80 NISCH (0.68) NISCHADRA1AADRA1DADRA1BHTR1A
Tymazoline SCHEMBL4415590 0.80 NISCH (0.68) NISCHADRA1AADRA1DADRA1BHTR1A
SCHEMBL3163294 0.80 WDR5 (0.57) NISCHADRA1AADRA1DADRA1BHTR1A
SCHEMBL3169242 0.80 NISCH (0.68) NISCHADRA1AADRA1DADRA1BHTR1A
SCHEMBL11265808 0.78 NISCH (0.60) NISCHADRA1AADRA1DADRA1BHTR1A
SCHEMBL3170332 0.77 NISCH (0.61) NISCHADRA1AADRA1DADRA1BHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4343809-A ANTIANEMIA THE DOW CHEMICAL COMPANY (US) 1982-08-10 US claimed
US-4343809-A ANTIANEMIA THE DOW CHEMICAL COMPANY (US) 1982-08-10 US disclosed