SCHEMBL8021471

SCHEMBL8021471

CC1c2cc(C(F)(F)F)ccc2CCN1C

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.52
HTR2B P41595 5/20 0.52
HTR2A P28223 4/20 0.52
MAOA P21397 3/20 0.51
PLAU P00749 1/20 0.42
NOTUM Q6P988 1/20 0.41
SLC6A4 P31645 3/20 0.41
KMT2A Q03164 1/20 0.40
ASIC3 Q9UHC3 1/20 0.40
SRD5A1 P18405 1/20 0.39
SLC6A2 P23975 1/20 0.39
TMEM97 Q5BJF2 1/20 0.39
SIGMAR1 Q99720 1/20 0.39

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
SCHEMBL2200079 0.79 HTR2A (0.57) HTR2CHTR2BHTR2ANOTUMSRD5A1
SCHEMBL8012740 0.79 MAOA (0.56) HTR2CHTR2AMAOAPLAUNOTUM
SCHEMBL8029002 0.79 MAOA (0.56) HTR2CHTR2AMAOAPLAUNOTUM
SCHEMBL8023881 0.77 MAOA (0.57) HTR2CHTR2BMAOAPLAUSLC6A4
SCHEMBL7655001 0.76 MAOA (0.56) HTR2AMAOAPLAUKMT2AASIC3
SCHEMBL29557733 0.76 MAOA (0.56) HTR2AMAOAPLAUKMT2AASIC3
SCHEMBL8024193 0.76 MAOA (0.56) HTR2CHTR2BHTR2AMAOAPLAU
SCHEMBL8028684 0.76 MAOA (0.56) HTR2CHTR2BHTR2AMAOAPLAU
Hydrochloric Acid SCHEMBL7513323 0.74 MAOA (0.54) HTR2AMAOAPLAUKMT2AASIC3
SCHEMBL15933206 0.73 HTR2C (0.67) HTR2CHTR2BHTR2ASLC6A4SRD5A1

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
WO-2009095253-A1 6-HALO-PYRAZOLO[1, 5-A]PYRIDINES, A PROCESS FOR THEIR PREPARATION AND THEIR USE AS METABOTROPIC GLUTAMATE RECEPTOR (MGLUR) MODULATORS MERZ PHARMA GMBH & CO. KGAA (DE) 2009-08-06 WO disclosed