SCHEMBL9570719

SCHEMBL9570719

Cc1ncn2c1CC(C(=O)n1ccc3ccccc31)CC2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TFPI2 P48307 2/20 0.41
NPY4R P50391 1/20 0.41
NOTUM Q6P988 1/20 0.41
HTR3E A5X5Y0 1/20 0.40
HTR3B O95264 1/20 0.40
CHRNB2 P17787 1/20 0.40
CHRNA7 P36544 1/20 0.40
CHRNA4 P43681 1/20 0.40
HTR3A P46098 1/20 0.40
HTR3D Q70Z44 1/20 0.40
HTR3C Q8WXA8 1/20 0.40
TSHR P16473 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
XIAP P98170 3/20 0.33
CDK2 P24941 1/20 0.33
MAPK8 P45983 1/20 0.33
MAPK9 P45984 1/20 0.33

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
SCHEMBL7024843 0.73 TFPI2 (0.58) TFPI2NPY4RNOTUMHTR3EHTR3B
SCHEMBL31435509 0.73 TFPI2 (0.58) TFPI2NPY4RNOTUMHTR3EHTR3B
SCHEMBL9570886 0.73 TFPI2 (0.36) TFPI2NPY4RNOTUMTSHRRAB9A
SCHEMBL6059869 0.70 HTR3A (0.44) TFPI2NPY4RNOTUMHTR3EHTR3B
SCHEMBL9570724 0.67 ADRA1A (0.46) TFPI2NPY4RNOTUMHTR3EHTR3B
SCHEMBL2078057 0.63 NOTUM (0.59) TFPI2NPY4RNOTUMHTR3EHTR3B
SCHEMBL29506395 0.61 NOTUM (1.00) TFPI2NPY4RNOTUMHTR3EHTR3B
SCHEMBL28471307 0.61 NOTUM (0.66) TFPI2NPY4RNOTUMHTR3EHTR3B
SCHEMBL41252 0.61 NOTUM (1.00) TFPI2NPY4RNOTUMHTR3EHTR3B
SCHEMBL14220747 0.61 TFPI2 (0.62) TFPI2NPY4RTSHRRAB9AMAPT

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
EP-0532754-A1 TETRAHYDROIMIDAZOPYRIDINE DERIVATIVE OR ITS SALT YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1993-03-24 EP claimed