SCHEMBL10132776

SCHEMBL10132776

CCC[C@@H](OC[C@H]1CO1)c1cccc(Cl)c1/C=C/C(=O)OCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 5/20 0.39
TDP1 Q9NUW8 1/20 0.39
MGLL Q99685 1/20 0.39
MAPT P10636 2/20 0.38
LMNA P02545 1/20 0.36
HPGD P15428 2/20 0.34
GLA P06280 1/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
CASP1 P29466 1/20 0.32
TTR P02766 1/20 0.32
DPP4 P27487 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32

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
SCHEMBL6742387 1.00 L3MBTL1 (0.39) L3MBTL1TDP1MGLLMAPTLMNA
SCHEMBL6741935 0.92 L3MBTL1 (0.40) L3MBTL1TDP1MGLLMAPTLMNA
SCHEMBL6742439 0.91 MGLL (0.41) L3MBTL1TDP1MGLLGLACA12
SCHEMBL10132715 0.91 MGLL (0.41) L3MBTL1TDP1MGLLGLACA12
SCHEMBL10132720 0.89 MGLL (0.39) L3MBTL1TDP1MGLLCA12CA1
SCHEMBL13263923 0.89 MGLL (0.39) L3MBTL1TDP1MGLLCA12CA1
SCHEMBL6742299 0.89 MGLL (0.39) L3MBTL1TDP1MGLLCA12CA1
SCHEMBL10132735 0.88 CYP1A2 (0.40) L3MBTL1TDP1MGLLMAPTLMNA
SCHEMBL6742367 0.88 CYP1A2 (0.40) L3MBTL1TDP1MGLLMAPTLMNA
SCHEMBL6742430 0.87 MGLL (0.41) L3MBTL1TDP1MGLLMAPTLMNA

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-8173631-B2 Cyclic amine compounds DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-05-08 US disclosed
US-8173631-B2 Cyclic amine compounds DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-05-08 US disclosed
US-20110319468-A1 CYCLIC AMINE COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-12-29 US disclosed
US-20110319468-A1 CYCLIC AMINE COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-12-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110319468-A1 CYCLIC AMINE COMPOUNDS RYR2, CASR, RYR1 L3MBTL1 4719/4885TDP1 3917/4885MGLL 2051/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.