SCHEMBL6610045

SCHEMBL6610045

CCCCCC(N)(O)CCN

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FDPS P14324 7/20 0.48
SMPD1 P17405 2/20 0.47
DNM1 Q05193 8/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
EPHX1 P07099 1/20 0.42
GGPS1 O95749 2/20 0.40

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
SCHEMBL5391830 0.87 FDPS (0.52) FDPSSMPD1TSHRGGPS1
SCHEMBL999922 0.87 FDPS (0.48) FDPSSMPD1GGPS1
SCHEMBL1271337 0.87 FDPS (0.52) FDPSSMPD1TSHRGGPS1
SCHEMBL7011302 0.85 FDPS (0.46) FDPSSMPD1GGPS1
SCHEMBL27323412 0.84 DNM1 (0.52) FDPSSMPD1DNM1MEN1KMT2A
SCHEMBL7719887 0.83 FDPS (0.48) FDPSSMPD1GGPS1
SCHEMBL14966859 0.82
SCHEMBL14840328 0.82 FDPS (0.48) FDPSSMPD1ALDH1A1TSHRGGPS1
SCHEMBL3032913 0.81 SMN1; SMN2 (0.43) FDPSSMPD1MEN1KMT2AALDH1A1
SCHEMBL4631586 0.81 SMN1; SMN2 (0.57) FDPSSMPD1MEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1389202-B1 2,6-SUBSTITUTED CHROMAN DERIVATIVES USEFUL AS BETA-3 ADRENORECEPTOR AGONISTS BAYER PHARMACEUTICALS CORP (US) 2004-09-29 EP disclosed