SCHEMBL27420071

SCHEMBL27420071

CCCOC(C)C(CC)OC(C)=O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
TDP1 Q9NUW8 1/20 0.36
TRPV1 Q8NER1 1/20 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
ALDH1A1 P00352 1/20 0.33
GALR3 O60755 1/20 0.33
MAPT P10636 1/20 0.33
BLM P54132 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL27385449 1.00 TSHR (0.38) TSHRTDP1TRPV1CHRM2CHRM4
SCHEMBL27420072 1.00 TSHR (0.38) TSHRTDP1TRPV1CHRM2CHRM4
SCHEMBL16010691 0.82 TSHR (0.42) TSHRTDP1TRPV1CHRM2CHRM4
SCHEMBL362428 0.81 TSHR (0.46) TSHRTDP1TRPV1CHRM2CHRM4
SCHEMBL7875149 0.76 TDP1 (0.48) TSHRTDP1TRPV1CHRM2CHRM4
Ethylene Glycol SCHEMBL8111484 0.76 TSHR (0.41) TSHRTDP1TRPV1CHRM2CHRM4
SCHEMBL2479739 0.75 TSHR (0.44) TSHRTDP1TRPV1CHRM2CHRM4
SCHEMBL12950160 0.75 TSHR (0.44) TSHRTDP1TRPV1CHRM2CHRM4
SCHEMBL1698005 0.74 TSHR (0.48) TSHRTDP1TRPV1CHRM2CHRM4
SCHEMBL1232896 0.74 TSHR (0.48) TSHRTDP1TRPV1CHRM2CHRM4

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
CN-1077570-C Novel sulfamate compound containing N-substituted carbamoyl group and preparation thereof SK LTD (KR) 2002-01-09 CN claimed
CN-1173864-A Novel sulfamate compound containing N-substituted carbamoyl group and preparation thereof YUKONG LTD (KR) 1998-02-18 CN claimed
CN-1077570-C Novel sulfamate compound containing N-substituted carbamoyl group and preparation thereof SK LTD (KR) 2002-01-09 CN disclosed
CN-1173864-A Novel sulfamate compound containing N-substituted carbamoyl group and preparation thereof YUKONG LTD (KR) 1998-02-18 CN disclosed