SCHEMBL8436951

SCHEMBL8436951

CCOC(=O)C1CC(O)CCN1C(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
FKBP1A P62942 2/20 0.42
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
CHRM3 P20309 1/20 0.42
ALDH1A1 P00352 2/20 0.41
TSHR P16473 2/20 0.41
HSD17B10 Q99714 2/20 0.40
CYP3A4 P08684 2/20 0.38
CYP1A2 P05177 1/20 0.38
POLB P06746 1/20 0.38
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 1/20 0.37
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37
LMNA P02545 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL8436953 1.00 MEN1 (0.43) MEN1KMT2AFKBP1ACHRM2CHRM1
SCHEMBL10473457 1.00 MEN1 (0.43) MEN1KMT2AFKBP1ACHRM2CHRM1
SCHEMBL10473454 1.00 MEN1 (0.43) MEN1KMT2AFKBP1ACHRM2CHRM1
SCHEMBL13611696 1.00 MEN1 (0.43) MEN1KMT2AFKBP1ACHRM2CHRM1
SCHEMBL1975652 0.87 CHRM2 (0.47) MEN1KMT2ACHRM2CHRM1CHRM3
SCHEMBL9635522 0.86 POLB (0.50) MEN1KMT2AFKBP1ACHRM2CHRM1
SCHEMBL3041685 0.86 POLB (0.50) MEN1KMT2AFKBP1ACHRM2CHRM1
SCHEMBL2202494 0.86 POLB (0.50) MEN1KMT2AFKBP1ACHRM2CHRM1
SCHEMBL116396 0.86 POLB (0.50) MEN1KMT2AFKBP1ACHRM2CHRM1
SCHEMBL2572678 0.86 POLB (0.50) MEN1KMT2AFKBP1ACHRM2CHRM1

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-5880138-A ANTAGONISTS OF EXCITATORY AMINO ACIDS ELI LILLY AND COMPANY (US) 1999-03-09 US disclosed
US-4968678-A NERVOUS SYSTEM DISORDERS ELI LILLY AND COMPANY (US) 1990-11-06 US disclosed