SCHEMBL13637124

SCHEMBL13637124

CC(=O)NCCCOc1ccc2nc(C#N)sc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.47
LMNA P02545 1/20 0.47
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
GAA P10253 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
MTNR1A P48039 5/20 0.44
MTNR1B P49286 5/20 0.44
DYRK1A Q13627 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C19 P33261 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL19410334 0.90 LMNA (0.45) LMNANPC1RAB9AMEN1MAPT
SCHEMBL906924 0.86 CA12 (0.49) LMNANPC1RAB9AKDM4EMAPT
SCHEMBL18383376 0.86 SMN1; SMN2 (0.47) LMNANPC1RAB9AMEN1ALDH1A1
SCHEMBL25338089 0.86 LMNA (0.46) LMNANPC1RAB9AGAAMEN1
SCHEMBL15080278 0.84 CYP3A4 (0.44) L3MBTL1LMNANPC1RAB9AMEN1
SCHEMBL12617413 0.84 CYP3A4 (0.44) L3MBTL1LMNANPC1RAB9AKDM4E
SCHEMBL19393239 0.83 LMNA (0.51) L3MBTL1LMNANPC1RAB9AGAA
SCHEMBL29575673 0.83 CA2 (0.48) LMNANPC1RAB9AKDM4ECACNA1H
SCHEMBL26549538 0.83 CA2 (0.48) LMNANPC1RAB9AKDM4ECACNA1H
SCHEMBL12312858 0.82 CA1 (0.50) L3MBTL1LMNANPC1RAB9AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9932365-B2 Protein labeling with cyanobenzothiazole conjugates PROMEGA CORPORATION (US) 2018-04-03 US disclosed
US-20170283456-A1 PROTEIN LABELING WITH CYANOBENZOTHIAZOLE CONJUGATES JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2017-10-05 US disclosed
US-20170283456-A1 PROTEIN LABELING WITH CYANOBENZOTHIAZOLE CONJUGATES JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2017-10-05 US disclosed
US-9689868-B2 Protein labeling with cyanobenzothiazole conjugates PROMEGA CORPORATION (US) 2017-06-27 US disclosed
US-9689868-B2 Protein labeling with cyanobenzothiazole conjugates PROMEGA CORPORATION (US) 2017-06-27 US disclosed
EP-3141905-A1 PROTEIN LABELING WITH CYANOBENZOTHIAZOLE CONJUGATES Promega Corporation (US) 2017-03-15 EP disclosed
US-20170016888-A1 PROTEIN LABELING WITH CYANOBENZOTHIAZOLE CONJUGATES JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2017-01-19 US disclosed
US-20170016888-A1 PROTEIN LABELING WITH CYANOBENZOTHIAZOLE CONJUGATES JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2017-01-19 US disclosed
US-9459249-B2 Protein labeling with cyanobenzothiazole conjugates PROMEGA CORPORATION (US) 2016-10-04 US disclosed
US-9459249-B2 Protein labeling with cyanobenzothiazole conjugates PROMEGA CORPORATION (US) 2016-10-04 US disclosed
WO-2009142678-A1 PROTEIN LABELING WITH CYANOBENZOTHIAZOLE CONJUGATES PROMEGA CORPORATIN (US) 2009-11-26 WO disclosed
US-20090263843-A1 Protein labeling with cyanobenzothiazole conjugates PROMEGA CORPORATION (US) 2009-10-22 US disclosed
US-20090263843-A1 Protein labeling with cyanobenzothiazole conjugates PROMEGA CORPORATION (US) 2009-10-22 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-20090263843-A1 Protein labeling with cyanobenzothiazole conjugates QPCTL, BCAT1, QPCT L3MBTL1 1238/4885LMNA 2607/4885NPC1 1719/4885
US-20170283456-A1 PROTEIN LABELING WITH CYANOBENZOTHIAZOLE CONJUGATES QPCTL, BCAT1, QPCT L3MBTL1 1238/4885LMNA 2607/4885NPC1 1719/4885

“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.