SCHEMBL7677574

SCHEMBL7677574

CCC1CCN(C(C)=O)C1C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.34
MEN1 O00255 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
DNMT1 P26358 2/20 0.33
POLB P06746 1/20 0.33
CHRM2 P08172 10/20 0.31
CHRM4 P08173 10/20 0.31
CHRM5 P08912 10/20 0.31
CHRM1 P11229 10/20 0.31
CHRM3 P20309 10/20 0.31

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
SCHEMBL19083908 1.00 ATM (0.34) ATMMEN1TSHRHTTKMT2A
SCHEMBL7677570 1.00 ATM (0.34) ATMMEN1TSHRHTTKMT2A
SCHEMBL7677569 1.00 ATM (0.34) ATMMEN1TSHRHTTKMT2A
Butane SCHEMBL7678465 0.96 MEN1 (0.33) ATMMEN1TSHRHTTKMT2A
SCHEMBL26119442 0.87 DNMT1 (0.34) DNMT1
SCHEMBL20629796 0.87 CHRM2 (0.32) MEN1TSHRHTTKMT2ACHRM2
SCHEMBL26115363 0.87 DNMT1 (0.34) DNMT1
SCHEMBL18771738 0.87 CHRM2 (0.32) MEN1TSHRHTTKMT2ACHRM2
SCHEMBL18771733 0.87 CHRM2 (0.32) MEN1TSHRHTTKMT2ACHRM2
SCHEMBL14339361 0.81 ATM (0.40) ATMMEN1TSHRHTTKMT2A

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-6350882-B1 REACTION OF PROLINE SALT AND ALKALI HALIDE WITH UNSATURATED ALDEHYDE, MIXING, ACIDIFICATION AND BASIFICATION MERCK & CO., INC. 2002-02-26 US disclosed