SCHEMBL18102944

SCHEMBL18102944

O=C1NC(=S)S/C1=C\c1cccc(Cl)c1O

nearest known ligand 0.74

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 3/20 0.74
▸ CRHBP P24387 2/20 0.67
▸ CRHR2 Q13324 2/20 0.67
▸ PLA2G1B P04054 1/20 0.67
▸ ATG4B Q9Y4P1 1/20 0.67
▸ NAT1 P18440 7/20 0.66
▸ PTP4A3 O75365 2/20 0.59
▸ MYC P01106 2/20 0.54
▸ MAX P61244 2/20 0.54
▸ CISD1 Q9NZ45 1/20 0.54
▸ PDE4B Q07343 1/20 0.54
▸ GSK3B P49841 2/20 0.53

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
SCHEMBL18103052 1.00 PIM1 (0.74) PIM1CRHBPCRHR2PLA2G1BATG4B
SCHEMBL18102942 0.86 NAT1 (0.78) PIM1CRHBPCRHR2PLA2G1BATG4B
SCHEMBL9251195 0.86 PIM1 (0.78) PIM1CRHBPCRHR2PLA2G1BATG4B
SCHEMBL9251192 0.86 PIM1 (0.78) PIM1CRHBPCRHR2PLA2G1BATG4B
SCHEMBL12892060 0.85 PIM1 (1.00) PIM1CRHBPCRHR2PLA2G1BATG4B
SCHEMBL18095820 0.83 NAT1 (0.66) PIM1CRHBPCRHR2PLA2G1BATG4B
SCHEMBL18103029 0.83 NAT1 (0.66) PIM1CRHBPCRHR2PLA2G1BATG4B
SCHEMBL18095819 0.83 NAT1 (0.66) PIM1CRHBPCRHR2PLA2G1BATG4B
SCHEMBL13499561 0.83 PIM1 (0.74) PIM1CRHBPCRHR2PLA2G1BATG4B
SCHEMBL14661291 0.81 PIM1 (0.70) PIM1CRHBPCRHR2NAT1PTP4A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10501413-B2 Inhibitors of the Notch transcriptional activation complex and methods for use of the same UNIVERSITY OF MIAMI (US) 2019-12-10 — — US disclosed
US-20180086700-A1 INHIBITORS OF THE NOTCH TRANSCRIPTIONAL ACTIVATION COMPLEX AND METHODS FOR USE OF THE SAME NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-03-29 — — US disclosed
US-20180086700-A1 INHIBITORS OF THE NOTCH TRANSCRIPTIONAL ACTIVATION COMPLEX AND METHODS FOR USE OF THE SAME NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2018-03-29 — — US disclosed
WO-2016154255-A1 INHIBITORS OF THE NOTCH TRANSCRIPTIONAL ACTIVATION COMPLEX AND METHODS FOR USE OF THE SAME UNIVERSITY OF MIAMI (US) 2016-09-29 — — 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 (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-10501413-B2 Inhibitors of the Notch transcriptional activation complex and methods for use of the same NOTCH1, CBFB, HES1 PIM1 2196/4885CRHBP 2621/4885CRHR2 4791/4885
US-20180086700-A1 INHIBITORS OF THE NOTCH TRANSCRIPTIONAL ACTIVATION COMPLEX AND METHODS FOR USE OF THE SAME NOTCH1, CBFB, HES1 PIM1 2196/4885CRHBP 2621/4885CRHR2 4791/4885

“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.

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