SCHEMBL16670474

SCHEMBL16670474

C=Cc1c(OCc2ccccc2)ccn(C2CCN(C(=O)OC(C)(C)C)CC2)c1=O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.48
STS P08842 1/20 0.46
GPR119 Q8TDV5 3/20 0.44
YAP1 P46937 3/20 0.44
CCR8 P51685 1/20 0.42
JAK2 O60674 1/20 0.42
JAK1 P23458 1/20 0.42
PRMT5 O14744 2/20 0.41
KDM4E B2RXH2 1/20 0.41
PKM P14618 1/20 0.41
GAA P10253 1/20 0.40
THRB P10828 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HCAR1 Q9BXC0 1/20 0.40
TLR9 Q9NR96 1/20 0.40
TLR7 Q9NYK1 1/20 0.40

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
SCHEMBL16670561 0.88 MAPK14 (0.55) MAPK14CCR8SMN1; SMN2
SCHEMBL6507357 0.86 YAP1 (0.46) MAPK14STSGPR119YAP1JAK2
SCHEMBL16669923 0.86 MAPK14 (0.46) MAPK14STSGPR119YAP1JAK2
SCHEMBL16670428 0.78 YAP1 (0.53) MAPK14STSGPR119YAP1JAK2
SCHEMBL26483782 0.74 YAP1 (0.47) STSGPR119YAP1JAK2JAK1
SCHEMBL3523774 0.74 HCAR1 (0.47) STSGPR119YAP1JAK2JAK1
SCHEMBL16669790 0.74 HCAR1 (0.41) STSGPR119KDM4EPKMHCAR1
SCHEMBL19970722 0.74 GPR119 (0.53) STSGPR119YAP1CCR8JAK2
SCHEMBL27369897 0.74 GPR119 (0.44) STSGPR119KDM4EPKMTHRB
SCHEMBL4482872 0.73 MAPK14 (0.52) MAPK14STSGPR119YAP1PRMT5

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3063139-B1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2018-11-21 EP disclosed
EP-3063139-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2016-09-07 EP disclosed
US-9120777-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-09-01 US disclosed
WO-2015064083-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-05-07 WO disclosed
US-20150119412-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-04-30 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-20150119412-A1 HETEROCYCLIC COMPOUND SSTR5, SSTR4, SSTR2 MAPK14 333/4885STS 299/4885GPR119 14/4885

“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.