SCHEMBL16670601

SCHEMBL16670601

CCOc1cc(C2CC2)c(C2CC2)cc1CN1CCC(n2ccc(C(=O)O)cc2=O)CC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 11/20 0.39
HRH2 P25021 3/20 0.39
KCNH2 Q12809 1/20 0.39
MAPT P10636 1/20 0.38
SSTR1 P30872 1/20 0.38
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
ALPL P05186 1/20 0.36
ALPI P09923 1/20 0.36
ALPG P10696 1/20 0.36
TSHR P16473 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TDP1 Q9NUW8 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
SCHEMBL16670082 0.97 SSTR5 (0.38) SSTR5HRH2KCNH2MAPTSSTR1
SCHEMBL16670319 0.88 KDM4E (0.36) SSTR5MAPTALPLALPIALPG
SCHEMBL16670334 0.88 SSTR5 (0.51) SSTR5KCNH2
SCHEMBL16670329 0.88 MEN1 (0.40) SSTR5HRH2HTR2AHTR2CHTR2B
SCHEMBL16683346 0.87 SSTR5 (0.44) SSTR5KCNH2ALDH1A1TDP1
SCHEMBL16670267 0.86 S1PR5 (0.36) SSTR5HRH2KCNH2
SCHEMBL16669602 0.85 ALDH1A1 (0.41) SSTR5HRH2MAPTTSHRALDH1A1
SCHEMBL16670277 0.84 SSTR5 (0.38) SSTR5HRH2KCNH2MAPTSSTR1
SCHEMBL16696344 0.81 SSTR5 (0.41) SSTR5KCNH2MAPTKDM4EALDH1A1
SCHEMBL28060601 0.81 SSTR5 (0.35) SSTR5HRH2KCNH2SSTR1TSHR

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 8 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
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
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 1/4885HRH2 1169/4885KCNH2 2199/4885

“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.