SCHEMBL11514599

SCHEMBL11514599

CCOC(=O)CN(C)C(=O)CN1CCCC1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.46
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
TP53 P04637 2/20 0.41
LMNA P02545 1/20 0.41
ADRA1D P25100 1/20 0.40
ADRA1A P35348 1/20 0.40
ADRA1B P35368 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ALDH1A1 P00352 2/20 0.39
MAPT P10636 1/20 0.39
HTT P42858 1/20 0.39
PKM P14618 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
PDK1 Q15118 1/20 0.38
PDK2 Q15119 1/20 0.38
PDK3 Q15120 1/20 0.38
PDK4 Q16654 1/20 0.38

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
SCHEMBL668453 0.87 TSHR (0.56) TSHRTP53LMNAADRA1DADRA1A
SCHEMBL11514068 0.83 LMNA (0.47) TSHRLMNAADRA1DADRA1AADRA1B
SCHEMBL11512605 0.82 TSHR (0.51) TSHRLMNAADRA1DADRA1AADRA1B
SCHEMBL11516137 0.82 TSHR (0.51) TSHRLMNAADRA1DADRA1AADRA1B
SCHEMBL6528311 0.82 TSHR (0.50) TSHRLMNAADRA1DADRA1AADRA1B
SCHEMBL9821321 0.81 TSHR (0.50) TSHRTP53LMNAADRA1DADRA1A
SCHEMBL11516159 0.81 TSHR (0.63) TSHRCA12CA1CA2CA9
SCHEMBL6495319 0.81 TSHR (0.49) TSHRLMNAADRA1DADRA1AADRA1B
SCHEMBL11243429 0.81 TSHR (0.56) TSHRLMNAADRA1DADRA1AADRA1B
SCHEMBL21389414 0.80 ADRA1D (0.45) TSHRTP53LMNAADRA1DADRA1A

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