SCHEMBL8380253

SCHEMBL8380253

OC1Cc2ccccc2C1I

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.40
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39
GRIN1 Q05586 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
GRIN3A Q8TCU5 1/20 0.39
KDM1A O60341 4/20 0.38
CHRNB2 P17787 1/20 0.38
CHRNA4 P43681 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
SCHEMBL23343868 1.00 ANPEP (0.40) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL12557463 1.00 ANPEP (0.40) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL23343759 1.00 ANPEP (0.40) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8378352 0.77 GRIN2D (0.42) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL783223 0.77 ANPEP (0.42) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL29833737 0.77 ANPEP (0.42) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL5271544 0.77 ANPEP (0.42) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL3867845 0.77 ANPEP (0.42) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL8049751 0.77 ANPEP (0.42) ANPEPGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL562559 0.77 ANPEP (0.42) ANPEPGRIN2DGRIN3BGRIN1GRIN2A

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
EP-0658537-B1 Method of producing cis-1-aminoindan-2-ol ICHIKAWA GOSEI KAGAKU KK (JP) 1999-03-31 EP disclosed
US-5760242-A Method of producing a cis-oxazoline ICHIKAWA GOSEI CHEMICAL CO., LTD. (JP) 1998-06-02 US disclosed
US-5648534-A Method of producing cis-1-aminoindan-2-ol ICHIKAWA GOSEI CHEMICAL CO., LTD. (JP) 1997-07-15 US disclosed
EP-0658537-A1 Method of producing cis-1-aminoindan-2-ol ICHIKAWA GOSEI CHEMICAL CO., LTD. (JP) 1995-06-21 EP disclosed