SCHEMBL5528066

SCHEMBL5528066

NNC(=O)C12CCC(CC1)C2

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.42
HTT P42858 4/20 0.42
NPSR1 Q6W5P4 1/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 1/20 0.42
DGAT1 O75907 1/20 0.38
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
MCOLN3 Q8TDD5 1/20 0.36
TSHR P16473 2/20 0.33
MAOB P27338 1/20 0.33
LMNA P02545 1/20 0.33
GLA P06280 1/20 0.32
KDM4E B2RXH2 1/20 0.32
EPHX1 P07099 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
SCHEMBL7481619 0.92 ALDH1A1 (0.39) ALDH1A1HTTNPSR1KMT2AMEN1
SCHEMBL5139210 0.86 DGAT1 (0.40) ALDH1A1HTTNPSR1KMT2AMEN1
SCHEMBL24038945 0.81
SCHEMBL1552389 0.77 MEN1 (0.63) ALDH1A1HTTNPSR1KMT2AMEN1
SCHEMBL218350 0.77 ALDH1A1 (0.40) ALDH1A1HTTNPSR1KMT2ACRHBP
SCHEMBL26928719 0.74 ALDH1A1 (0.55) ALDH1A1HTTKMT2AMEN1CRHBP
SCHEMBL28417551 0.74 ALDH1A1 (0.41) ALDH1A1HTTNPSR1KMT2ALMNA
SCHEMBL3079757 0.74 ALDH1A1 (0.41) ALDH1A1HTTNPSR1KMT2ATSHR
SCHEMBL27405417 0.74 ALDH1A1 (0.46) ALDH1A1HTTNPSR1KMT2ATSHR
SCHEMBL22548447 0.73 ALDH1A1 (0.41) ALDH1A1HTTNPSR1KMT2AMEN1

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-1674526-B9 POLYACETAL RESIN COMPOSITION POLYPLASTICS CO (JP) 2013-05-29 EP disclosed
EP-1674526-B1 POLYACETAL RESIN COMPOSITION POLYPLASTICS CO (JP) 2012-12-05 EP disclosed
US-20070032605-A1 Polyacetal resin composition POLYPLASTICS CO., LTD. (JP) 2007-02-08 US disclosed
EP-1674526-A1 POLYACETAL RESIN COMPOSITION Polyplastics Co., Ltd. (JP) 2006-06-28 EP disclosed