SCHEMBL19180004

SCHEMBL19180004

COC(=O)c1ccccc1S(=O)(=O)N(C)c1cscc1Br

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA5A P35218 1/20 0.51
CA9 Q16790 1/20 0.51
KMT2A Q03164 2/20 0.48
GAA P10253 3/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ALDH1A1 P00352 2/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.41
NPC1 O15118 1/20 0.39
SLC40A1 Q9NP59 1/20 0.38
C5AR1 P21730 1/20 0.38
LMNA P02545 3/20 0.38
HPGD P15428 1/20 0.38
MAPK1 P28482 1/20 0.38
MEN1 O00255 1/20 0.37
MMP9 P14780 1/20 0.37
MMP13 P45452 1/20 0.37

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
SCHEMBL6541115 0.78 KMT2A (0.57) CA1CA2CA5ACA9KMT2A
SCHEMBL19181393 0.78 CA1 (0.50) CA1CA2CA5ACA9KMT2A
SCHEMBL6627930 0.75 CA1 (0.65) CA1CA2CA5ACA9KMT2A
SCHEMBL19180007 0.75 SLC40A1 (0.56) CA1CA2CA5ACA9KMT2A
SCHEMBL7073806 0.72 CA1 (0.52) CA1CA2CA5ACA9KMT2A
SCHEMBL1466405 0.72 CA1 (0.52) CA1CA2CA5ACA9KMT2A
SCHEMBL9677113 0.72 CA1 (0.59) CA1CA2CA5ACA9KMT2A
SCHEMBL6542414 0.72 CA1 (0.49) CA1CA2CA5ACA9KMT2A
SCHEMBL15482281 0.72 CA1 (0.49) CA1CA2CA5ACA9KMT2A
SCHEMBL25221412 0.71 GAA (0.76) KMT2AGAANPSR1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240092802-A1 MU-OPIOID RECEPTOR AGONISTS AND USES THEREFOR KURES, INC. 2024-03-21 US disclosed
EP-3116509-B1 A NEW CLASS OF MU-OPIOID RECEPTOR AGONISTS UNIV COLUMBIA (US) 2022-06-22 EP disclosed
US-20220106279-A1 CLASS OF MU-OPIOID RECEPTOR AGONISTS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2022-04-07 US disclosed
US-20220106279-A1 CLASS OF MU-OPIOID RECEPTOR AGONISTS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2022-04-07 US disclosed
US-20190084949-A1 NEW CLASS OF MU-OPIOID RECEPTOR AGONISTS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2019-03-21 US disclosed
US-20190084949-A1 NEW CLASS OF MU-OPIOID RECEPTOR AGONISTS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2019-03-21 US disclosed
US-10183919-B2 Class of mu-opioid receptor agonists THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2019-01-22 US disclosed
US-10183919-B2 Class of mu-opioid receptor agonists THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2019-01-22 US disclosed
US-20170217913-A1 A NEW CLASS OF MU-OPIOID RECEPTOR AGONISTS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2017-08-03 US disclosed
US-20170217913-A1 A NEW CLASS OF MU-OPIOID RECEPTOR AGONISTS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2017-08-03 US disclosed
US-20170217913-A1 A NEW CLASS OF MU-OPIOID RECEPTOR AGONISTS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2017-08-03 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 (5 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-20240092802-A1 MU-OPIOID RECEPTOR AGONISTS AND USES THEREFOR OPRL1, OPRM1, CDKL5 CA1 4222/4885CA2 4303/4885CA5A 1055/4885
US-10183919-B2 Class of mu-opioid receptor agonists OPRM1, OPRL1, OPRK1 CA1 3391/4885CA2 2065/4885CA5A 2711/4885
US-20220106279-A1 CLASS OF MU-OPIOID RECEPTOR AGONISTS OPRM1, OPRL1, OPRK1 CA1 3391/4885CA2 2065/4885CA5A 2711/4885
US-20190084949-A1 NEW CLASS OF MU-OPIOID RECEPTOR AGONISTS OPRM1, OPRL1, OPRK1 CA1 4040/4885CA2 2927/4885CA5A 2987/4885
US-20170217913-A1 A NEW CLASS OF MU-OPIOID RECEPTOR AGONISTS OPRM1, OPRL1, OPRK1 CA1 4029/4885CA2 2533/4885CA5A 2917/4885

“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.