SCHEMBL10166265

SCHEMBL10166265

CCOC(=O)/C=C/c1cc(Cl)ccc1[C@@H](C)OCC1CO1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.40
MAPT P10636 3/20 0.39
ALDH1A1 P00352 1/20 0.39
P2RX3 P56373 3/20 0.38
ESR1 P03372 1/20 0.38
TTR P02766 1/20 0.37
DPP4 P27487 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
CYP3A4 P08684 2/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAOB P27338 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
SCHEMBL2481304 1.00 MGLL (0.40) MGLLMAPTALDH1A1P2RX3ESR1
SCHEMBL6742816 0.94 MGLL (0.41) MGLLMAPTALDH1A1P2RX3ESR1
SCHEMBL6742127 0.90 MGLL (0.39) MGLLMAPTALDH1A1P2RX3ESR1
SCHEMBL10151369 0.89 MGLL (0.41) MGLLMAPTESR1TTRDPP4
SCHEMBL2476675 0.89 MGLL (0.41) MGLLMAPTESR1TTRDPP4
SCHEMBL10151059 0.88 MGLL (0.41) MGLLMAPTALDH1A1P2RX3ESR1
SCHEMBL2477015 0.88 MGLL (0.41) MGLLMAPTALDH1A1P2RX3ESR1
SCHEMBL2673357 0.88 TBXA2R (0.38) MGLLMAPTP2RX3CA12CA1
SCHEMBL2673360 0.88 TBXA2R (0.38) MGLLMAPTP2RX3CA12CA1
SCHEMBL2673363 0.88 TBXA2R (0.38) MGLLMAPTP2RX3CA12CA1

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-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

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 MGLL 2051/4885MAPT 1170/4885ALDH1A1 2584/4885

“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.