SCHEMBL18102858

SCHEMBL18102858

O=C1NC(=S)S/C1=C\c1cc(Cl)ccc1O

nearest known ligand 0.75

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PTP4A3 O75365 4/20 0.75
▸ CRHBP P24387 2/20 0.75
▸ CRHR2 Q13324 2/20 0.75
▸ PLA2G1B P04054 1/20 0.67
▸ ATG4B Q9Y4P1 1/20 0.67
▸ NAT1 P18440 4/20 0.66
▸ GSK3B P49841 1/20 0.62
▸ MYC P01106 2/20 0.61
▸ MAX P61244 2/20 0.61
▸ DNM1 Q05193 1/20 0.58
▸ PIM1 P11309 1/20 0.58
▸ CISD1 Q9NZ45 3/20 0.56
▸ MGAM O43451 1/20 0.55
▸ GAA P10253 1/20 0.55
▸ SI P14410 1/20 0.55
▸ MGAM2 Q2M2H8 1/20 0.55
▸ MAOB P27338 1/20 0.54

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
SCHEMBL18102957 0.89 PTP4A3 (0.71) PTP4A3CRHBPCRHR2PLA2G1BATG4B
SCHEMBL28965550 0.86 PTP4A3 (1.00) PTP4A3CRHBPCRHR2PLA2G1BATG4B
SCHEMBL18102943 0.86 PTP4A3 (0.75) PTP4A3CRHBPCRHR2PLA2G1BATG4B
SCHEMBL3405860 0.83 PTP4A3 (0.71) PTP4A3CRHBPCRHR2PLA2G1BATG4B
SCHEMBL3405858 0.83 PTP4A3 (0.71) PTP4A3CRHBPCRHR2PLA2G1BATG4B
SCHEMBL14464055 0.83 PTP4A3 (0.71) PTP4A3CRHBPCRHR2PLA2G1BATG4B
SCHEMBL8174037 0.83 PTP4A3 (0.71) PTP4A3CRHBPCRHR2PLA2G1BATG4B
SCHEMBL8174040 0.83 PTP4A3 (0.71) PTP4A3CRHBPCRHR2PLA2G1BATG4B
SCHEMBL13616173 0.83 PTP4A3 (0.71) PTP4A3CRHBPCRHR2PLA2G1BATG4B
SCHEMBL14464056 0.83 PTP4A3 (1.00) PTP4A3CRHBPCRHR2PLA2G1BATG4B

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 PTP4A3 4245/4885CRHBP 2621/4885CRHR2 4791/4885
US-20180086700-A1 INHIBITORS OF THE NOTCH TRANSCRIPTIONAL ACTIVATION COMPLEX AND METHODS FOR USE OF THE SAME NOTCH1, CBFB, HES1 PTP4A3 4245/4885CRHBP 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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