SCHEMBL7982038

SCHEMBL7982038

C=C(C)c1ccc(F)c(Cl)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
TAS1R3 Q7RTX0 3/20 0.41
TAS1R1 Q7RTX1 3/20 0.41
TAS1R2 Q8TE23 3/20 0.41
MAPT P10636 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
CASP3 P42574 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SMN1; SMN2 Q16637 4/20 0.40
ALDH1A1 P00352 2/20 0.40
HTT P42858 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
KCNQ3 O43525 1/20 0.40
KCNQ2 O43526 1/20 0.40
KCNE1 P15382 1/20 0.40
KCNQ1 P51787 1/20 0.40
TSHR P16473 1/20 0.39
P2RX7 Q99572 1/20 0.38

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
SCHEMBL8296527 0.83 KCNQ3 (0.41) MAOBKCNQ3KCNQ2KCNE1KCNQ1
SCHEMBL15517335 0.83 TAS1R3 (0.43) MAOAMAOBTAS1R3TAS1R1TAS1R2
SCHEMBL8252464 0.81 KCNQ3 (0.44) MAOAMAOBTAS1R3TAS1R1TAS1R2
SCHEMBL16956565 0.81 TAS1R3 (0.45) MAOAMAOBTAS1R3TAS1R1TAS1R2
SCHEMBL2014424 0.80 TSHR (0.52) MAPTMEN1KMT2ASMN1; SMN2TSHR
SCHEMBL6963321 0.80 CES2 (0.54) MAOAMAOBTAS1R3TAS1R1TAS1R2
SCHEMBL31599679 0.80 TSHR (0.52) MAPTMEN1KMT2ASMN1; SMN2TSHR
SCHEMBL16955007 0.80 TAS1R3 (0.39) MAOAMAOBTAS1R3TAS1R1TAS1R2
SCHEMBL18405331 0.79 TAS1R3 (0.41) MAOAMAOBTAS1R3TAS1R1TAS1R2
SCHEMBL75563 0.79 MEN1 (0.51) MAOAMAOBTAS1R3TAS1R1TAS1R2

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-2009140101-A2 IMIDAZOPYRIDINE COMPOUNDS USEFUL AS MMP-13 INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-11-19 WO disclosed