SCHEMBL18896237

SCHEMBL18896237

CCCCCCCCNC(=O)c1cnco1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 4/20 0.54
HPGD P15428 2/20 0.54
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
LMNA P02545 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.48
PKM P14618 1/20 0.46
EPHX1 P07099 5/20 0.44
MLYCD O95822 1/20 0.43
TSHR P16473 1/20 0.43
GPR84 Q9NQS5 1/20 0.43
CA2 P00918 1/20 0.43

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
SCHEMBL5199877 0.87 POLB (0.53) HPGDKDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL17725298 0.80 ACACB (0.43) HPGD
SCHEMBL30865420 0.76 HPGD (0.79) NAAAHPGDALDH1A1SMN1; SMN2LMNA
SCHEMBL30865440 0.76 HPGD (0.79) NAAAHPGDALDH1A1SMN1; SMN2LMNA
SCHEMBL30865492 0.76 HPGD (0.79) NAAAHPGDALDH1A1SMN1; SMN2LMNA
SCHEMBL30865488 0.76 HPGD (0.79) NAAAHPGDALDH1A1SMN1; SMN2LMNA
SCHEMBL30865472 0.76 HPGD (0.79) NAAAHPGDALDH1A1SMN1; SMN2LMNA
SCHEMBL8551555 0.75 CYP1A2 (0.47) HPGDKDM4EALDH1A1SMN1; SMN2MLYCD
SCHEMBL9784444 0.74 SMN1; SMN2 (0.84) NAAAHPGDALDH1A1SMN1; SMN2LMNA
SCHEMBL15999997 0.74 SMN1; SMN2 (0.84) NAAAHPGDALDH1A1SMN1; SMN2LMNA

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
US-9663466-B2 Aryl dihydropyridinones and piperidinone MGAT2 inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2017-05-30 US disclosed