SCHEMBL27365812

SCHEMBL27365812

CC(C)NN(C)C1CCCC1

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ADH1C P00326 2/20 0.37
ADH1A P07327 2/20 0.37
ADH1B P00325 1/20 0.37
TSHR P16473 1/20 0.34
FAAH O00519 1/20 0.32
PHGDH O43175 1/20 0.32
MGLL Q99685 1/20 0.32
JAK3 P52333 1/20 0.31

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
SCHEMBL27461334 0.97 ADH1A (0.40) ADH1CADH1AADH1BTSHRFAAH
SCHEMBL27398983 0.92
SCHEMBL20733726 0.72
SCHEMBL8979133 0.70 ADH1A (0.42) ADH1CADH1AADH1BFAAHPHGDH
SCHEMBL23229253 0.69
SCHEMBL12228052 0.68 PHGDH (0.41) ADH1CADH1AADH1BFAAHPHGDH
SCHEMBL104779 0.67 ADH1A (0.44) ADH1CADH1AADH1BTSHRFAAH
SCHEMBL11171433 0.67 ADH1A (0.40) ADH1CADH1AADH1BTSHRFAAH
SCHEMBL24329483 0.67 ADH1C (0.39) ADH1CADH1AADH1BFAAHPHGDH
SCHEMBL7727423 0.67 ADH1C (0.39) ADH1CADH1AADH1BFAAHPHGDH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1063442-C Aminothiazole derivatives, drug containing the same and intermediate in the production of the compounds ZERIA PHARM CO LTD (JP) 2001-03-21 CN disclosed
CN-1184471-A Aminothiazole derivatives, drug containing the same and intermediate in the production of the compounds ZERIA PHARM CO LTD (JP) 1998-06-10 CN disclosed