SCHEMBL8634102

SCHEMBL8634102

C=CC(C)C(N)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.56
ADRA2A P08913 1/20 0.45
ADRA2C P18825 1/20 0.45
LMNA P02545 1/20 0.45
HIF1A Q16665 1/20 0.45
KDM4E B2RXH2 1/20 0.45
F2 P00734 1/20 0.44
ALDH1A1 P00352 1/20 0.43
TAAR1 Q96RJ0 3/20 0.41

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
SCHEMBL17300288 1.00 DPP4 (0.56) DPP4ADRA2AADRA2CLMNAHIF1A
SCHEMBL17300289 1.00 DPP4 (0.56) DPP4ADRA2AADRA2CLMNAHIF1A
SCHEMBL13056307 0.83 DPP4 (0.36) DPP4LMNAALDH1A1
SCHEMBL13056306 0.83 DPP4 (0.36) DPP4LMNAALDH1A1
SCHEMBL13246731 0.81 HTR2A (0.38) DPP4ALDH1A1
SCHEMBL13267831 0.81 HTR2A (0.38) DPP4ALDH1A1
SCHEMBL8781412 0.80 DPP4 (0.54) DPP4ADRA2AADRA2CLMNAHIF1A
SCHEMBL2996389 0.78 CYP1A2 (0.44) KDM4EALDH1A1
SCHEMBL2996386 0.78 CYP1A2 (0.44) KDM4EALDH1A1
SCHEMBL13267800 0.78 CYP1A2 (0.44) KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5773617-A USING A REAGENT THAT CONTAINS A SOLVENT SYSTEM, A SOLUBLE COORDINATION CATALYST AND A SOLUBLE NUCLEOPHILIC COMPOUND RHONE-POULENC CHIMIE (FR) 1998-06-30 US disclosed
US-5712343-A Preparation of organopolysiloxane microemulsions WACKER-CHEMIE GMBH (DE) 1998-01-27 US disclosed
US-5630474-A ENHANCED OIL RECOVERY USING AQUEOUS EMULSION CONTAINING POLYSILOXANE AND SURFACTANT WACKER-CHEMIE GMBH (DE) 1997-05-20 US disclosed
US-5523365-A Graft copolymers of organopolysiloxanes as free radical macroinitiators WACKER-CHEMIE GMBH (DE) 1996-06-04 US disclosed