SCHEMBL17005191

SCHEMBL17005191

C=CCN(CC(=O)c1ccccn1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.45
LMNA P02545 2/20 0.45
NAPRT Q6XQN6 1/20 0.45
P4HTM Q9NXG6 1/20 0.45
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
KMT2A Q03164 4/20 0.41
CTNNB1 P35222 4/20 0.40
ALDH1A1 P00352 4/20 0.40
WNT3A P56704 3/20 0.40
GRM4 Q14833 1/20 0.40
NPC1 O15118 2/20 0.40
PKM P14618 2/20 0.40
RAB9A P51151 2/20 0.40
KDM4E B2RXH2 2/20 0.40
MAPT P10636 1/20 0.40
MITF O75030 1/20 0.40
CDK5 Q00535 1/20 0.40
CDK5R1 Q15078 1/20 0.40
GPR52 Q9Y2T5 1/20 0.39

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
SCHEMBL15549461 0.81 SMN1; SMN2 (0.39) L3MBTL1LMNANAPRTP4HTMCES2
SCHEMBL20524441 0.81 LMNA (0.49) L3MBTL1LMNANAPRTP4HTMCES2
SCHEMBL27883073 0.80 CES2 (0.48) L3MBTL1LMNANAPRTP4HTMCES2
SCHEMBL15658741 0.80 KDM4E (0.45) LMNANAPRTKMT2AALDH1A1NPC1
SCHEMBL20237246 0.80 ALDH1A1 (0.48) L3MBTL1KMT2AALDH1A1NPC1PKM
SCHEMBL15282567 0.79 ALDH1A1 (0.45) L3MBTL1LMNACES1KMT2AALDH1A1
SCHEMBL15660113 0.78 SMN1; SMN2 (0.43) L3MBTL1LMNAP4HTMKMT2AALDH1A1
SCHEMBL17014180 0.78 CTNNB1 (0.42) L3MBTL1LMNANAPRTP4HTMCES2
SCHEMBL11128987 0.77 LMNA (0.45) L3MBTL1LMNANAPRTP4HTMCES2
SCHEMBL4555882 0.75 CES2 (0.53) L3MBTL1LMNANAPRTP4HTMCES2

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
EP-2912041-B1 TETRAHYDROPYRROLOTHIAZINE DERIVATIVES AS BACE INHIBITORS LILLY CO ELI (US) 2016-12-14 EP disclosed
US-9328124-B2 BACE inhibitors ELI LILLY AND COMPANY (US) 2016-05-03 US disclosed
US-20150232483-A1 BACE INHIBITORS ELI LILLY AND COMPANY 2015-08-20 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-20150232483-A1 BACE INHIBITORS BACE1, BACE2, APP L3MBTL1 2957/4885LMNA 3047/4885NAPRT 2861/4885

“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.