SCHEMBL11512938

SCHEMBL11512938

CCOC(=O)CNC(=O)CN1CCCC1=O

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.48
TSHR P16473 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
GAA P10253 2/20 0.45
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 2/20 0.44
HPGD P15428 2/20 0.44
USP2 O75604 1/20 0.44
HSD17B10 Q99714 1/20 0.44
LMNA P02545 1/20 0.43
KMT2A Q03164 3/20 0.43
NQO2 P16083 1/20 0.42
MAPT P10636 1/20 0.42
MEN1 O00255 1/20 0.41
NLRP3 Q96P20 1/20 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
SCHEMBL11512914 0.95 GAA (0.43) HTTTSHRSMN1; SMN2GAAALDH1A1
SCHEMBL9492570 0.87 HTT (0.51) HTTTSHRSMN1; SMN2KDM4ELMNA
SCHEMBL11110801 0.84 HTT (0.49) HTTTSHRSMN1; SMN2KDM4ELMNA
SCHEMBL668453 0.84 TSHR (0.56) HTTTSHRALDH1A1LMNAKMT2A
SCHEMBL3936078 0.82 TSHR (0.51) HTTTSHRSMN1; SMN2GAAALDH1A1
SCHEMBL1397958 0.81 HTT (0.56) HTTTSHRSMN1; SMN2LMNAKMT2A
SCHEMBL11513567 0.80 HTT (0.57) HTTTSHRLMNAKMT2ANQO2
SCHEMBL11512586 0.80 KMT2A (0.54) HTTTSHRSMN1; SMN2LMNAKMT2A
SCHEMBL9206004 0.79 HTT (0.59) HTTTSHRSMN1; SMN2ALDH1A1LMNA
SCHEMBL6528311 0.79 TSHR (0.50) HTTTSHRALDH1A1LMNAKMT2A

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-4162325-A PHARMACEUTICAL ACTIVITY ON THE MNEMIC PROCESSES UCB, SOCIETE ANONYME (BE) 1979-07-24 US disclosed