SCHEMBL3701339

SCHEMBL3701339

Cc1cccc(Sc2cc(CCNC(=O)O)nn2-c2ccccc2Cl)n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
TP53 P04637 2/20 0.35
SLC16A3 O15427 4/20 0.35
SLC16A1 P53985 3/20 0.35
PDE4B Q07343 1/20 0.34
MAPT P10636 3/20 0.34
KMT2A Q03164 3/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 2/20 0.34
POLB P06746 1/20 0.34
NPC1 O15118 1/20 0.34
MITF O75030 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
NFKB1 P19838 1/20 0.34
RAB9A P51151 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 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
SCHEMBL3697426 0.89 SLC16A3 (0.38) SMN1; SMN2TP53SLC16A3SLC16A1PDE4B
SCHEMBL4130915 0.86 SLC16A3 (0.41) LMNASMN1; SMN2SLC16A3SLC16A1KMT2A
SCHEMBL4125828 0.84 P2RX7 (0.39) SMN1; SMN2SLC16A3SLC16A1PDE4BMAPT
SCHEMBL4140877 0.83 SLC16A3 (0.38) SMN1; SMN2SLC16A3SLC16A1PDE4BMAPT
SCHEMBL3701337 0.83 SLC16A3 (0.36) LMNASLC16A3SLC16A1PDE4B
SCHEMBL2838853 0.82 SLC6A4 (0.39) LMNASMN1; SMN2PDE4BMAPTKDM4E
SCHEMBL4134986 0.82 SMN1; SMN2 (0.36) SMN1; SMN2TP53SLC16A3SLC16A1PDE4B
SCHEMBL3708990 0.81 P2RX7 (0.39) SMN1; SMN2SLC16A3SLC16A1PDE4BMAPT
SCHEMBL4201749 0.81 SLC16A3 (0.36) LMNASLC16A3SLC16A1PDE4BKMT2A
SCHEMBL4201755 0.79 SLC16A3 (0.36) SLC16A3SLC16A1PDE4BKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2190822-B1 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2014-12-31 EP disclosed
EP-2190822-A2 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS Takeda Pharmaceutical Company Limited (JP) 2010-06-02 EP disclosed
WO-2009041705-A9 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS TAKEDA PHARMACEUTICAL (JP) 2009-08-13 WO disclosed
US-20090156642-A1 5-Membered heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 US disclosed
WO-2009041705-A2 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-04-02 WO 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-20090156642-A1 5-Membered heterocyclic compound CEL, PGA5, COG5 LMNA 4283/4885SMN1; SMN2 4327/4885TP53 4668/4885

“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.