SCHEMBL1704746

SCHEMBL1704746

O=C1NC(=S)NC(=O)C1=C/C=C/c1ccco1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 1.00
TDP1 Q9NUW8 3/20 0.68
MEN1 O00255 15/20 0.66
KMT2A Q03164 15/20 0.66
RECQL P46063 14/20 0.66
MAPT P10636 13/20 0.66
APEX1 P27695 3/20 0.66
KDM4E B2RXH2 3/20 0.66
ALPL P05186 1/20 0.66
ALPI P09923 1/20 0.66
ALPG P10696 1/20 0.66
DUSP3 P51452 1/20 0.62
METAP1 P53582 1/20 0.59
MAPK1 P28482 10/20 0.59
NPSR1 Q6W5P4 10/20 0.59
MITF O75030 8/20 0.59
PKM P14618 6/20 0.59
GFER P55789 3/20 0.59
POLB P06746 9/20 0.57
ALDH1A1 P00352 7/20 0.57

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
SCHEMBL13024523 1.00 F2 (1.00) F2TDP1MEN1KMT2ARECQL
SCHEMBL1065724 1.00 F2 (1.00) F2TDP1MEN1KMT2ARECQL
SCHEMBL14712884 0.88 F2 (0.78) F2TDP1MEN1KMT2ARECQL
SCHEMBL3181280 0.81 TDP1 (1.00) F2TDP1MEN1KMT2ARECQL
SCHEMBL16542997 0.78 DUSP3 (1.00) F2TDP1MEN1KMT2ARECQL
SCHEMBL20156860 0.78 F2 (0.63) F2TDP1MEN1KMT2ARECQL
SCHEMBL3471124 0.77 MEN1 (0.80) F2TDP1MEN1KMT2ARECQL
SCHEMBL3471120 0.77 MEN1 (0.80) F2TDP1MEN1KMT2ARECQL
SCHEMBL14712984 0.77 MEN1 (0.80) F2TDP1MEN1KMT2ARECQL
SCHEMBL8172539 0.77 F2 (0.62) F2TDP1MEN1KMT2ARECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230145071-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION 2023-05-11 US disclosed
US-20230145071-A1 MASP-2 INHIBITORS AND METHODS OF USE OMEROS CORPORATION 2023-05-11 US disclosed
US-11584714-B2 MASP-2 inhibitors and methods of use OMEROS CORPORATION (US) 2023-02-21 US disclosed
US-9994554-B2 Barbiturate and thiobarbiturate compounds for use in cancer therapy NUHOPE LLC (US) 2018-06-12 US disclosed
US-9994554-B2 Barbiturate and thiobarbiturate compounds for use in cancer therapy NUHOPE LLC (US) 2018-06-12 US disclosed
US-20180134691-A1 BARBITURATE AND THIOBARBITURATE COMPOUNDS FOR USE IN CANCER THERAPY NUHOPE, LLC (US) 2018-05-17 US disclosed
US-20180134691-A1 BARBITURATE AND THIOBARBITURATE COMPOUNDS FOR USE IN CANCER THERAPY NUHOPE, LLC (US) 2018-05-17 US disclosed
US-9878998-B2 Barbiturate and thiobarbiturate compounds for use in cancer therapy NUHOPE LLC (US) 2018-01-30 US disclosed
US-9878998-B2 Barbiturate and thiobarbiturate compounds for use in cancer therapy NUHOPE LLC (US) 2018-01-30 US disclosed
US-20150065531-A1 COMPOUNDS FOR USE IN CANCER THERAPY CONNOR, JAMES R. 2015-03-05 US disclosed
US-20150065531-A1 COMPOUNDS FOR USE IN CANCER THERAPY CONNOR, JAMES R. 2015-03-05 US disclosed
EP-2222326-B2 INHIBITORS OF MALT1 PROTEOLYTIC ACTIVITY AND USES THEREOF VIB VZW (BE) 2015-02-25 EP disclosed
EP-2222326-B1 Inhibitors of MALT1-proteolytic activity and uses thereof VIB VZW (BE) 2012-04-18 EP disclosed
US-20110021548-A1 INHIBITORS OF MALT1 PROTEOLYTIC ACTIVITY AND USES THEREOF UNIVERSITEIT GENT (BE) 2011-01-27 US disclosed
US-20110021548-A1 INHIBITORS OF MALT1 PROTEOLYTIC ACTIVITY AND USES THEREOF UNIVERSITEIT GENT (BE) 2011-01-27 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-11584714-B2 MASP-2 inhibitors and methods of use MASP2, METAP2, SPINT2 F2 4188/4885TDP1 1427/4885MEN1 157/4885
US-20230145071-A1 MASP-2 INHIBITORS AND METHODS OF USE MASP2, METAP2, SPINT2 F2 4188/4885TDP1 1427/4885MEN1 157/4885
US-20180134691-A1 BARBITURATE AND THIOBARBITURATE COMPOUNDS FOR USE IN CANCER THERAPY MGMT, BCL2, BAX F2 4684/4885TDP1 153/4885MEN1 2410/4885
US-20150065531-A1 COMPOUNDS FOR USE IN CANCER THERAPY MGMT, BCL2, BAK1 F2 4611/4885TDP1 289/4885MEN1 1885/4885
US-20110021548-A1 INHIBITORS OF MALT1 PROTEOLYTIC ACTIVITY AND USES THEREOF MMEL1, CTRL, ZFR F2 4498/4885TDP1 520/4885MEN1 1339/4885

“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.