SCHEMBL1625535

SCHEMBL1625535

OCCNCc1ccc(CNCCO)cc1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.64
PDCD1 Q15116 2/20 0.60
CD274 Q9NZQ7 2/20 0.60
ALDH1A1 P00352 1/20 0.56
TSHR P16473 1/20 0.56
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
TDP1 Q9NUW8 1/20 0.52
GSR P00390 2/20 0.48
CHRM2 P08172 4/20 0.46
MCHR1 Q99705 1/20 0.46
MAOA P21397 1/20 0.46
HRH4 Q9H3N8 1/20 0.45
HRH3 Q9Y5N1 1/20 0.45
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.44

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
SCHEMBL1822940 0.91 SMN1; SMN2 (0.56) SMN1; SMN2PDCD1CD274ALDH1A1TSHR
SCHEMBL5853981 0.89 CYP1A2 (0.56) SMN1; SMN2PDCD1CD274ALDH1A1TSHR
SCHEMBL4599034 0.89 CHRM2 (0.64) SMN1; SMN2PDCD1CD274ALDH1A1TSHR
SCHEMBL2263025 0.89 CHRM2 (0.64) SMN1; SMN2PDCD1CD274ALDH1A1TSHR
SCHEMBL6081998 0.89 SMN1; SMN2 (0.55) SMN1; SMN2PDCD1CD274ALDH1A1TSHR
SCHEMBL8252697 0.89 L3MBTL1 (0.56) SMN1; SMN2PDCD1CD274ALDH1A1TSHR
SCHEMBL7991882 0.89 CHRM2 (0.64) SMN1; SMN2PDCD1CD274ALDH1A1TSHR
SCHEMBL19401259 0.87 MEN1 (0.73) SMN1; SMN2PDCD1CD274MEN1KMT2A
SCHEMBL177039 0.87 MEN1 (0.73) SMN1; SMN2PDCD1CD274MEN1KMT2A
Hydrochloric Acid SCHEMBL948529 0.87 CHRM2 (0.62) SMN1; SMN2PDCD1CD274ALDH1A1MEN1

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-1897901-B1 BIODEGRADABLE POLYMER, PRODUCTION METHOD THEREOF, MOLDED PRODUCT THEREOF, AND USE THEREOF MITSUI CHEMICALS INC (JP) 2015-03-11 EP disclosed
US-7928180-B2 Biodegradable polymer, production method thereof, molded product thereof, and use thereof MITSUI CHEMICALS, INC. (JP) 2011-04-19 US disclosed
US-20090142982-A1 Biodegradable Polymer, Production Method Thereof, Molded Product Thereof, and Use Thereof MITSUI CHEMICALS INC. (JP) 2009-06-04 US disclosed
EP-1897901-A1 BIODEGRADABLE POLYMER, PRODUCTION METHOD THEREOF, MOLDED PRODUCT THEREOF, AND USE THEREOF Mitsui Chemicals, Inc. (JP) 2008-03-12 EP disclosed