SCHEMBL27682102

SCHEMBL27682102

O=C1CC(Cl)C(=O)N1OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 3/20 0.42
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
MAPT P10636 1/20 0.42
GAA P10253 3/20 0.41
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 5/20 0.41
HPGD P15428 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
STAT6 P42226 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
TSHR P16473 3/20 0.38
ALOX15 P16050 1/20 0.37
EHMT2 Q96KQ7 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
SCHEMBL6184918 0.81 ALDH1A1 (0.44) KCNA5MEN1KMT2AMAPTGAA
SCHEMBL4698180 0.81 ALDH1A1 (0.41) KCNA5MEN1KMT2AMAPTGAA
SCHEMBL4703293 0.81 ALDH1A1 (0.41) KCNA5MEN1KMT2AMAPTGAA
SCHEMBL4179162 0.81 ALDH1A1 (0.44) KCNA5MEN1KMT2AMAPTGAA
Hydrochloric Acid SCHEMBL4698659 0.80 ALDH1A1 (0.40) KCNA5MEN1KMT2AMAPTGAA
SCHEMBL10402245 0.80 KMT2A (0.52) MEN1KMT2AMAPTGAAPOLB
Hydrochloric Acid SCHEMBL4698117 0.80 ALDH1A1 (0.40) KCNA5MEN1KMT2AMAPTGAA
Hydrochloric Acid SCHEMBL4698115 0.80 ALDH1A1 (0.40) KCNA5MEN1KMT2AMAPTGAA
SCHEMBL4700879 0.77 CYP2C19 (0.42) KMT2AL3MBTL1ALDH1A1HPGDCYP2C19
SCHEMBL4698178 0.77 CYP2C19 (0.42) KMT2AL3MBTL1ALDH1A1HPGDCYP2C19

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
CN-101035776-A Enantiomerically pure heterocyclic compounds for the preparation of peptides potentially useful as medicaments SOLVAY (BE) 2007-09-12 CN disclosed