SCHEMBL3095319

SCHEMBL3095319

CCOC(=O)CCNC(=O)c1ccc(NC(c2cc(-c3ccc(OCCCSC)cc3)oc2C)C2CCCCC2)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 2/20 0.36
GAA P10253 1/20 0.36
GCG P01275 2/20 0.35
POLB P06746 1/20 0.35
HPGD P15428 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
ALDH1A1 P00352 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
SCHEMBL3110170 0.93 MEN1 (0.42) MAPTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL3095400 0.90 MAPT (0.41) MAPTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL3100942 0.90 MAPT (0.41) MAPTSMN1; SMN2MEN1KMT2ALMNA
SCHEMBL13094284 0.89 GCG (0.41) GCG
SCHEMBL3106498 0.88 ESR1 (0.34) MAPTMEN1KMT2ALMNAGAA
SCHEMBL3090795 0.86 RCE1 (0.41) MAPTMEN1KMT2ALMNAGAA
SCHEMBL3104529 0.82 GCG (0.41) GCG
SCHEMBL716647 0.82 MEN1 (0.42) MAPTSMN1; SMN2MEN1KMT2AGCG
SCHEMBL3102238 0.82 GCG (0.41) GCG
SCHEMBL3110137 0.81 MEN1 (0.43) SMN1; SMN2MEN1KMT2ALMNAGCG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2210876-B1 HETEROCYCLIC COMPOUND AS GLUCAGON ANTAGONIST TAKEDA PHARMACEUTICAL (JP) 2015-05-20 EP disclosed
US-8309580-B2 Heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-11-13 US disclosed
US-20100256156-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-10-07 US disclosed
EP-2210876-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2010-07-28 EP 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-20100256156-A1 HETEROCYCLIC COMPOUND GLP1R, GPR119, GCGR MAPT 4877/4885SMN1; SMN2 4692/4885MEN1 233/4885

“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.