SCHEMBL16670327

SCHEMBL16670327

COc1c(CN2CCC(n3ccc(C(=O)O)cc3=O)CC2)cc(C2CC2)c(-c2ccc(F)cc2)c1Cl

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 15/20 0.51
KCNH2 Q12809 1/20 0.39
HRH2 P25021 1/20 0.36
KMT2A Q03164 1/20 0.35
DRD3 P35462 2/20 0.34
ACKR3 P25106 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
SCHEMBL16670836 0.92 SSTR5 (0.52) SSTR5KCNH2
SCHEMBL16669769 0.87 SSTR5 (0.38) SSTR5HRH2KMT2A
SCHEMBL16670300 0.86 SSTR5 (0.38) SSTR5KCNH2HRH2
SCHEMBL16669669 0.84 SSTR5 (0.50) SSTR5KCNH2HRH2KMT2AACKR3
SCHEMBL16669865 0.83 SSTR5 (0.41) SSTR5KCNH2HRH2
SCHEMBL16683344 0.81 SSTR5 (0.47) SSTR5KCNH2HRH2KMT2AACKR3
SCHEMBL16670139 0.80 SSTR5 (0.59) SSTR5KCNH2
SCHEMBL16670334 0.79 SSTR5 (0.51) SSTR5KCNH2
SCHEMBL16670349 0.79 SSTR5 (0.42) SSTR5KCNH2HRH2KMT2ADRD3
SCHEMBL16669938 0.79 SSTR5 (0.52) SSTR5KCNH2HRH2KMT2A

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 7 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
US-9120777-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-09-01 US disclosed
US-9120777-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-09-01 US disclosed
US-9120777-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-09-01 US disclosed
US-20150119412-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-04-30 US disclosed
US-20150119412-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-04-30 US 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 SSTR5 1/4885KCNH2 2199/4885HRH2 1169/4885

“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.