SCHEMBL3928027

SCHEMBL3928027

CCN1CCC(NC=O)C1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ADH1B P00325 4/20 0.43
ADH1A P07327 4/20 0.43
ADH1C P00326 3/20 0.40
ADH7 P40394 2/20 0.40
ADH4 P08319 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.36
EPHX1 P07099 2/20 0.36
EPHX2 P34913 1/20 0.36
RECQL P46063 1/20 0.34
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
DRD4 P21917 1/20 0.32
GNAI3 P08754 1/20 0.32
GNAO1 P09471 1/20 0.32
GNAI1 P63096 1/20 0.32
GAA P10253 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL3926638 0.89 ADH1B (0.47) ADH1BADH1AADH1CADH7ADH4
SCHEMBL1781920 0.88 ADH1B (0.52) ADH1BADH1AADH1CADH7ADH4
SCHEMBL172647 0.85 ADH1B (0.40) ADH1BADH1AADH1CADH7ADH4
Hydrochloric Acid SCHEMBL28635747 0.79 GNAO1 (0.55) GNAI3GNAO1GNAI1
SCHEMBL21757741 0.79 ADH1B (0.34) ADH1BADH1AADH1CADH7ADH4
Hydrochloric Acid SCHEMBL28625285 0.79 GNAO1 (0.55) GNAI3GNAO1GNAI1
SCHEMBL28278574 0.78 ADH1B (0.40) ADH1BADH1AADH1CADH7ADH4
SCHEMBL22702139 0.78 SMN1; SMN2 (0.34) SMN1; SMN2EPHX1EPHX2RECQLKDM4E
SCHEMBL2549878 0.75
SCHEMBL13832821 0.75

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
EP-2925737-B1 TRICYCLIC COMPOUNDS FOR USE IN THE TREATMENT AND/OR CONTROL OF OBESITY ZAFGEN INC (US) 2017-06-14 EP disclosed
WO-2009007390-A2 2-PYRAZ INYLBENZ IMIDAZOLE DERIVATIVES AS RECEPTOR TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2009-01-15 WO disclosed