SCHEMBL529923

SCHEMBL529923

COC(=O)C(CBr)OC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
TSHR P16473 2/20 0.39
TDP1 Q9NUW8 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM1 P11229 1/20 0.34
TBXA2R P21731 1/20 0.34
ZDHHC7 Q9NXF8 1/20 0.34
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33
GALR3 O60755 1/20 0.33
MAPT P10636 1/20 0.33
BLM P54132 1/20 0.33
TRPV1 Q8NER1 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32

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
SCHEMBL10632108 0.82 ZDHHC7 (0.37) ALDH1A1TSHRTDP1SMN1; SMN2ZDHHC7
SCHEMBL7395531 0.82 CA1 (0.41) ALDH1A1TSHRTDP1SMN1; SMN2CHRM2
SCHEMBL7276080 0.80 TDP1 (0.48) ALDH1A1TSHRTDP1SMN1; SMN2CHRM2
SCHEMBL11601602 0.80 SMN1; SMN2 (0.34) SMN1; SMN2ZDHHC7CA1CA2CA14
SCHEMBL15945449 0.78 TSHR (0.41) ALDH1A1TSHRTDP1SMN1; SMN2CHRM2
SCHEMBL1657391 0.78 ALDH1A1 (0.36) ALDH1A1TSHRTDP1SMN1; SMN2CHRM2
SCHEMBL29210738 0.78 ALOX15 (0.46) ALDH1A1TSHRTDP1SMN1; SMN2CHRM2
SCHEMBL15945448 0.78 CA1 (0.42) ALDH1A1TSHRTDP1SMN1; SMN2CHRM2
SCHEMBL10012505 0.78 MGAM (0.39) ALDH1A1TSHRTDP1SMN1; SMN2CHRM2
SCHEMBL27992948 0.78 MGAM (0.39) ALDH1A1TSHRTDP1SMN1; SMN2CHRM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10023689-B2 Functional biodegradable polymers THE UNIVERSITY OF AKRON 2018-07-17 US disclosed
US-20160229952-A1 FUNCTIONAL BIODEGRADABLE POLYMERS NATIONAL SCIENCE FOUNDATION 2016-08-11 US disclosed
US-20130184429-A1 FUNCTIONAL BIODEGRADABLE POLYMERS THE UNIVERSITY OF AKRON (US) 2013-07-18 US disclosed
EP-2598552-A1 FUNCTIONAL BIODEGRADABLE POLYMERS University Of Akron (US) 2013-06-05 EP disclosed
WO-2012015481-A1 FUNCTIONAL BIODEGRADABLE POLYMERS UNIVERSITY OF AKRON (US) 2012-02-02 WO disclosed