SCHEMBL9911084

SCHEMBL9911084

C=CCCCC(COS(C)(=O)=O)COS(C)(=O)=O

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
TSHR P16473 4/20 0.35
USP2 O75604 3/20 0.35
LMNA P02545 3/20 0.35
KDM4E B2RXH2 1/20 0.35
MMP9 P14780 1/20 0.35
ALOX15 P16050 1/20 0.35
CA2 P00918 2/20 0.34
CA9 Q16790 1/20 0.34
CYP3A4 P08684 2/20 0.33
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HPGD P15428 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA7 P43166 1/20 0.32
CA14 Q9ULX7 1/20 0.32
RECQL P46063 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
SCHEMBL25410314 0.76 KDM4E (0.36) ALDH1A1TSHRUSP2LMNAKDM4E
SCHEMBL5154099 0.75 TSHR (0.39) ALDH1A1TSHRUSP2CA2CA9
SCHEMBL6621065 0.74 ALDH1A1 (0.61) ALDH1A1TSHRUSP2LMNAKDM4E
SCHEMBL9709607 0.74 NLRP3 (0.32)
SCHEMBL1606138 0.72 TSHR (0.65) ALDH1A1TSHRUSP2LMNAKDM4E
SCHEMBL10151688 0.71 CA1 (0.59) ALDH1A1TSHRUSP2LMNAKDM4E
SCHEMBL1606611 0.71 TSHR (0.62) ALDH1A1TSHRUSP2LMNAKDM4E
SCHEMBL20495987 0.71 TSHR (0.62) ALDH1A1TSHRUSP2LMNAKDM4E
SCHEMBL11176516 0.71 TSHR (0.62) ALDH1A1TSHRUSP2LMNAKDM4E
SCHEMBL9432188 0.71 TSHR (0.62) ALDH1A1TSHRUSP2LMNAKDM4E

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-8198390-B2 Self assembled grafted polymeric layer for use in biosensor technology IMEC (BE) 2012-06-12 US disclosed
US-20100204415-A1 SELFASSEMBLED GRAFTED POLYMERIC LAYER FOR USE IN BIOSENSOR TECHNOLOGY IMEC (BE) 2010-08-12 US disclosed