SCHEMBL7951815

SCHEMBL7951815

[CH2]C(C)CC(CC[CH]C)Oc1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.38
MAOB P27338 3/20 0.38
ADRA2A P08913 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
NISCH Q9Y2I1 1/20 0.38
POLB P06746 2/20 0.34
KDM4E B2RXH2 2/20 0.33
SLC6A4 P31645 1/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
CHRNB4 P30926 2/20 0.32
CHRNA3 P32297 2/20 0.32
LMNA P02545 1/20 0.32
LTB4R Q15722 1/20 0.32
LTB4R2 Q9NPC1 1/20 0.32
S1PR5 Q9H228 2/20 0.31
S1PR1 P21453 1/20 0.31
ALDH1A1 P00352 1/20 0.30
FFAR1 O14842 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
SCHEMBL1455125 0.80 SLC6A4 (0.37) MAOAMAOBADRA2AADRA2BADRA2C
SCHEMBL1454315 0.79 SLC6A4 (0.36) MAOAMAOBADRA2AADRA2BADRA2C
SCHEMBL1455296 0.76 MTNR1A (0.45) MAOAMAOBADRA2AADRA2BADRA2C
SCHEMBL1455116 0.71 SLC6A4 (0.35) MAOAMAOBADRA2AADRA2BADRA2C
SCHEMBL1454212 0.70 MTNR1A (0.42) MAOAMAOBADRA2AADRA2BADRA2C
SCHEMBL1454451 0.70 SLC7A5 (0.36) MAOAMAOBADRA2AADRA2BADRA2C
SCHEMBL9770515 0.68 SLC6A4 (0.38) MAOAMAOBADRA2AADRA2BADRA2C
SCHEMBL1454232 0.67 SLC6A4 (0.37) POLBKDM4ESLC6A4MTNR1AMTNR1B
SCHEMBL1454220 0.66 POLB (0.36) MAOAMAOBADRA2AADRA2BADRA2C
SCHEMBL27658477 0.66 AOX1 (0.41) MAOAMAOBADRA2AADRA2BADRA2C

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-6262197-B1 AS POLYMERIZATION CATALYST IN OLEFIN POLYMERIZATION TARGOR GMBH (DE) 2001-07-17 US disclosed
EP-0739897-A1 Polynuclear metallocene compound, process for preparing it and its use as catalyst HOECHST AKTIENGESELLSCHAFT (DE) 1996-10-30 EP disclosed