SCHEMBL9004155

SCHEMBL9004155

CCC(/C=C\c1ccc(OC)cc1)=N\OCCN(C)C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
HTR2A P28223 1/20 0.46
HTR2C P28335 1/20 0.46
HTR2B P41595 1/20 0.46
GSK3B P49841 1/20 0.44
BCHE P06276 1/20 0.44
F3 P13726 2/20 0.43
TRPM8 Q7Z2W7 1/20 0.43
THRB P10828 1/20 0.42
ATM Q13315 1/20 0.42
UTS2R Q9UKP6 2/20 0.42
MAOB P27338 3/20 0.41
MAOA P21397 1/20 0.41
HDAC1 Q13547 2/20 0.40
TAS1R3 Q7RTX0 2/20 0.40
TAS1R1 Q7RTX1 2/20 0.40
HDAC3 O15379 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40

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
SCHEMBL9004076 0.89 MCHR1 (0.46) LMNASMN1; SMN2GSK3BBCHEF3
SCHEMBL9004100 0.86 HTR2A (0.46) LMNASMN1; SMN2HTR2AHTR2CHTR2B
SCHEMBL9004102 0.85 HTR2A (0.51) HTR2AHTR2CHTR2BBCHEMAOB
SCHEMBL9004093 0.78 BCHE (0.51) LMNASMN1; SMN2HTR2AHTR2CHTR2B
Hydrochloric Acid SCHEMBL9420988 0.77 HTR2A (0.63) LMNASMN1; SMN2HTR2AHTR2CHTR2B
SCHEMBL9004104 0.76 TRPA1 (0.66) LMNASMN1; SMN2GSK3BF3THRB
SCHEMBL9004121 0.76 HTR2A (0.45) LMNASMN1; SMN2HTR2AHTR2CHTR2B
SCHEMBL9004115 0.76 HTR2A (0.45) LMNASMN1; SMN2HTR2AHTR2CHTR2B
SCHEMBL9004122 0.76 HTR2A (0.45) LMNASMN1; SMN2HTR2AHTR2CHTR2B
Oxalic Acid SCHEMBL9420998 0.76 HTR2A (0.55) LMNASMN1; SMN2HTR2AHTR2CHTR2B

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-5486528-A ANTIULCER AGENTS, ANXIOLYTIC AGENTS EGIS GYOGYSZERGYAR RT. (HU) 1996-01-23 US disclosed
EP-0619299-A2 1-(Phenyl)-3-[omega-(amino)-alkoxyimino]-alk-1-ene derivatives, a process for preparing them as well as medicaments containing them and the use of them EGIS GYOGYSZERGYAR RT. (HU) 1994-10-12 EP disclosed