SCHEMBL9602159

SCHEMBL9602159

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

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
FKBP1A P62942 2/20 0.39
ALDH1A1 P00352 2/20 0.38
TSHR P16473 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 2/20 0.37
NR1H2 P55055 1/20 0.36
KDM4E B2RXH2 1/20 0.35
GLA P06280 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
LMNA P02545 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL15080547 1.00 MEN1 (0.40) MEN1KMT2AFKBP1AALDH1A1TSHR
SCHEMBL8441308 0.90 NR1H2 (0.44) MEN1KMT2AFKBP1AALDH1A1TSHR
SCHEMBL10473651 0.88 SMN1; SMN2 (0.41) MEN1KMT2AFKBP1AALDH1A1SMN1; SMN2
SCHEMBL10473648 0.88 SMN1; SMN2 (0.41) MEN1KMT2AFKBP1AALDH1A1SMN1; SMN2
SCHEMBL10473647 0.88 SMN1; SMN2 (0.41) MEN1KMT2AFKBP1AALDH1A1SMN1; SMN2
SCHEMBL9602272 0.84 MEN1 (0.39) MEN1KMT2AFKBP1AALDH1A1TSHR
SCHEMBL3116971 0.84 GPR119 (0.38) MEN1KMT2AFKBP1ANR1H2
SCHEMBL10473808 0.83 FKBP1A (0.40) MEN1KMT2AFKBP1AALDH1A1TSHR
SCHEMBL10473809 0.83 FKBP1A (0.40) MEN1KMT2AFKBP1AALDH1A1TSHR
SCHEMBL9854340 0.83 FKBP1A (0.40) MEN1KMT2AFKBP1AALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5217963-A Antiischemic, antiepileptic agent CIBA-GEIGY CORPORATION (US) 1993-06-08 US disclosed
US-5057506-A Anticonvulsants, antispasmodic and antischemic agents CIBA-GEIGY CORPORATION (US) 1991-10-15 US disclosed
US-4906621-A Certain 2-carboxypiperidyl-alkylene phosphonic acids and esters thereof useful for the treatment of disorders responsive to N-methyl-D-aspartate receptor blockade CIBA-GEIGY CORPORATION (US) 1990-03-06 US disclosed
US-4898854-A NERVOUS SYSTEM DISORDERS CIBA-GEIGY CORPORATION (US) 1990-02-06 US disclosed