SCHEMBL15980408

SCHEMBL15980408

CC(=O)NC1CCN(C)CC1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OGA O60502 3/20 0.38
SSTR1 P30872 1/20 0.36
SSTR4 P31391 1/20 0.36
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
CA12 O43570 1/20 0.34
CA9 Q16790 1/20 0.34
PSEN1 P49768 3/20 0.33
PSEN2 P49810 3/20 0.33
APH1B Q8WW43 3/20 0.33
NCSTN Q92542 3/20 0.33
APH1A Q96BI3 3/20 0.33
PSENEN Q9NZ42 3/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SLC6A2 P23975 2/20 0.32
SLC6A4 P31645 2/20 0.32
SLC6A3 Q01959 2/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL8280849 0.82 OGA (0.41) OGACYP2C9CYP2C19PSEN1PSEN2
SCHEMBL26620621 0.81 SSTR4 (0.48) SSTR1SSTR4
SCHEMBL18347993 0.81 CHRNB4 (0.36) SSTR1SSTR4
SCHEMBL18361599 0.81 SSTR1 (0.37) SSTR1SSTR4
SCHEMBL21564569 0.80 SSTR4 (0.44) OGASSTR1SSTR4CA1CA2
SCHEMBL20276654 0.80 EPHX2 (0.41) OGACA1CA2CA12CA9
SCHEMBL15521171 0.79 OGA (0.45) OGACYP2C9CYP2C19PSEN1PSEN2
SCHEMBL15521326 0.79 OGA (0.45) OGACYP2C9CYP2C19PSEN1PSEN2
SCHEMBL15521173 0.79 OGA (0.45) OGACYP2C9CYP2C19PSEN1PSEN2
SCHEMBL20069710 0.78 RET (0.36) SSTR1SSTR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180170874-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-06-21 US disclosed
US-9133129-B2 Bicyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-09-15 US disclosed
US-20140243310-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-08-28 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 (2 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-20180170874-A1 HETEROCYCLIC COMPOUND SPTLC1, SPTLC2, NPC1 OGA 2255/4885SSTR1 3044/4885SSTR4 3449/4885
US-20140243310-A1 BICYCLIC COMPOUND BICRA, NR3C2, CYP11B2 OGA 4670/4885SSTR1 357/4885SSTR4 581/4885

“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.