SCHEMBL7712918

SCHEMBL7712918

COCCC(N)OC(C)=O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.38
TSHR P16473 2/20 0.37
DDAH1 O94760 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33
TBXA2R P21731 1/20 0.33
GALR3 O60755 1/20 0.32
MAPT P10636 1/20 0.32
BLM P54132 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
ALOX15 P16050 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
SCHEMBL7710509 0.82
SCHEMBL11240366 0.77
SCHEMBL301895 0.77
SCHEMBL933721 0.77
SCHEMBL17014686 0.77 TSHR (0.40) ALDH1A1TSHRCHRM2CHRM4CHRM1
SCHEMBL6524619 0.76 TSHR (0.44) ALDH1A1TSHRCHRM2CHRM4CHRM1
SCHEMBL11457956 0.76 TSHR (0.39) ALDH1A1TSHRCHRM2CHRM4CHRM1
SCHEMBL11455456 0.76 TSHR (0.39) ALDH1A1TSHRCHRM2CHRM4CHRM1
SCHEMBL27242 0.76 TSHR (0.48) ALDH1A1TSHRCHRM2CHRM4CHRM1
Hydrochloric Acid SCHEMBL27728870 0.76 TSHR (0.39) ALDH1A1TSHRCHRM2CHRM4CHRM1

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
US-6361940-B1 IMMOBILIZATION; GENETIC ENGINEERING QIAGEN GENOMICS, INC. 2002-03-26 US disclosed
EP-0952228-A2 Compositions and methods for enhancing hybridization specificity Rapigene, Inc. (US) 1999-10-27 EP disclosed