SCHEMBL12858792

SCHEMBL12858792

CCCOCCOCCNC(=O)CCS

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
EPHX2 P34913 1/20 0.41
CASP2 P42575 1/20 0.39
CA12 O43570 4/20 0.38
CA1 P00915 4/20 0.38
CA2 P00918 4/20 0.38
CA4 P22748 4/20 0.38
CA9 Q16790 4/20 0.38
CA14 Q9ULX7 4/20 0.38
TSHR P16473 1/20 0.38
DNM1 Q05193 2/20 0.38
CNR1 P21554 1/20 0.37
NAAA Q02083 1/20 0.37
FAAH O00519 2/20 0.36
GLP1R P43220 3/20 0.36
ENPP2 Q13822 1/20 0.35
LPAR1 Q92633 1/20 0.35
LPAR2 Q9HBW0 1/20 0.35

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
SCHEMBL26234016 0.98 EPHX2 (0.42) MEN1KMT2AEPHX2CASP2CA12
SCHEMBL13073508 0.89 SMN1; SMN2 (0.42) MEN1KMT2AEPHX2CA12CA1
SCHEMBL27142729 0.87 CASP2 (0.52) MEN1KMT2AEPHX2CASP2CA12
SCHEMBL11915802 0.87 CASP2 (0.52) MEN1KMT2AEPHX2CASP2CA12
SCHEMBL25887649 0.87 CASP2 (0.52) MEN1KMT2AEPHX2CASP2CA12
SCHEMBL24982767 0.87 MEN1 (0.46) MEN1KMT2AEPHX2CASP2CA12
SCHEMBL13644566 0.87 CASP2 (0.52) MEN1KMT2AEPHX2CASP2CA12
SCHEMBL19544544 0.87 MEN1 (0.46) MEN1KMT2AEPHX2CASP2CA12
SCHEMBL16309409 0.85 SMN1; SMN2 (0.44) MEN1KMT2AEPHX2CASP2CA1
SCHEMBL25908214 0.85 CASP2 (0.50) MEN1KMT2AEPHX2CASP2CA12

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-7892781-B2 Detecting a target using a composite probe comprising a directing agent, a metal nanoparticle and an enzyme NANOPROBES, INC. (US) 2011-02-22 US disclosed
US-20080318249-A1 Methods and reagents to increase the sensitivity of enzyme metallographic detection NANOPROBES, INC. 2008-12-25 US disclosed