SCHEMBL2722975

SCHEMBL2722975

O=C(O)c1ccc(NC(=O)c2sccc2Cl)c(NC(=O)c2sccc2Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PRSS12 P56730 2/20 0.60
KMT2A Q03164 6/20 0.60
MEN1 O00255 5/20 0.60
NPC1 O15118 3/20 0.52
RAB9A P51151 2/20 0.52
F10 P00742 2/20 0.50
ALDH1A1 P00352 3/20 0.48
PKM P14618 2/20 0.46
MAPT P10636 2/20 0.45
POLB P06746 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CASP3 P42574 1/20 0.44
SENP8 Q96LD8 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
GAA P10253 2/20 0.43
AGTR1 P30556 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL2724379 0.78 F10 (0.48) PRSS12KMT2AMEN1F10ALDH1A1
SCHEMBL1308098 0.76 GRIK1 (0.55) PRSS12KMT2AMEN1NPC1RAB9A
SCHEMBL786139 0.75 KMT2A (0.52) PRSS12KMT2AMEN1NPC1RAB9A
SCHEMBL2722988 0.74 PYGL (0.48) KMT2AMEN1NPC1RAB9AF10
SCHEMBL1859781 0.70 GAA (0.69) KMT2AMEN1NPC1RAB9AF10
SCHEMBL154710 0.70
SCHEMBL22871301 0.69 PKM (0.60) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL25199724 0.69 KMT2A (0.68) KMT2AMEN1NPC1RAB9AALDH1A1
SCHEMBL5008226 0.69 CASP3 (0.45) PRSS12KMT2AMEN1NPC1RAB9A
SCHEMBL30500273 0.69 KMT2A (0.68) KMT2AMEN1NPC1RAB9AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130261130-A1 NEUROTRYPSIN INHIBITORS NEUROTUNE AG (CH) 2013-10-03 US disclosed
US-20130261130-A1 NEUROTRYPSIN INHIBITORS NEUROTUNE AG (CH) 2013-10-03 US disclosed
US-20130261130-A1 NEUROTRYPSIN INHIBITORS NEUROTUNE AG (CH) 2013-10-03 US disclosed
EP-2635559-A2 NEUROTRYPSIN INHIBITORS Neurotune AG (CH) 2013-09-11 EP disclosed
WO-2012059442-A2 NEUROTRYPSIN INHIBITORS NEUROTUNE AG (CH) 2012-05-10 WO disclosed
WO-2012059442-A2 NEUROTRYPSIN INHIBITORS NEUROTUNE AG (CH) 2012-05-10 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-20130261130-A1 NEUROTRYPSIN INHIBITORS MTPN, CHRNA7, CHRNA10 PRSS12 5/4885KMT2A 3851/4885MEN1 3294/4885

“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.