SCHEMBL8537358

SCHEMBL8537358

O=C(NCCO)c1ccc2c(ccn2-c2ccc(OC3CCN(C(=O)O)C3)cn2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK1 Q13464 2/20 0.41
CHRNA7 P36544 2/20 0.40
MAPT P10636 4/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
ACACB O00763 2/20 0.37
PLK1 P53350 2/20 0.36
PLK3 Q9H4B4 2/20 0.36
PLK2 Q9NYY3 2/20 0.36
KMT2A Q03164 2/20 0.36
POLB P06746 1/20 0.36
F10 P00742 1/20 0.36
RAB9A P51151 3/20 0.35
NPC1 O15118 2/20 0.35
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
KDM4E B2RXH2 1/20 0.35
TP53 P04637 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL8533555 0.95 ROCK1 (0.42) ROCK1CHRNA7MAPTL3MBTL1PLK1
SCHEMBL8530737 0.89 PIK3CD (0.41) CHRNA7L3MBTL1
SCHEMBL15253243 0.87 GPR119 (0.42) ROCK1CHRNA7MAPTL3MBTL1ACACB
SCHEMBL8535909 0.86 GPR119 (0.52) MAPTL3MBTL1ACACBKMT2ARAB9A
SCHEMBL15253109 0.86 CHEK2 (0.42) MAPTL3MBTL1KDM4E
SCHEMBL9262615 0.85 KDM1A (0.42) ROCK1CHRNA7MAPTPLK1PLK3
SCHEMBL9268476 0.84 ACACB (0.42) ACACBPLK1PLK3PLK2
SCHEMBL15253108 0.84 ROCK1 (0.38) ROCK1MAPTL3MBTL1PLK1PLK3
SCHEMBL8533100 0.83 CSF1R (0.40) ROCK1L3MBTL1ACACBPOLBRAB9A
SCHEMBL9256413 0.82 GPR119 (0.44) ROCK1MAPTACACBPLK1PLK3

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-9000175-B2 Bicyclic GPR119 modulators LUPIN LIMITED (IN) 2015-04-07 US disclosed
EP-2643311-A1 BICYCLIC GPR119 MODULATORS Lupin Limited (IN) 2013-10-02 EP disclosed
US-20130245000-A1 BICYCLIC GPR119 MODULATORS LUPIN LIMITED (IN) 2013-09-19 US disclosed
WO-2012069917-A1 BICYCLIC GPR119 MODULATORS LUPIN LIMITED (IN) 2012-05-31 WO 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-20130245000-A1 BICYCLIC GPR119 MODULATORS GPR119, GPR180, GPBAR1 ROCK1 2378/4885CHRNA7 497/4885MAPT 4305/4885

“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.