SCHEMBL13499579

SCHEMBL13499579

O=C1NC(=S)S/C1=C\c1ccc(F)cc1F

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTP4A3 O75365 5/20 0.67
▸ NAT1 P18440 5/20 0.64
▸ CRHBP P24387 1/20 0.55
▸ CRHR2 Q13324 1/20 0.55
▸ PIM1 P11309 1/20 0.54
▸ MYC P01106 1/20 0.53
▸ MAX P61244 1/20 0.53
▸ CA2 P00918 2/20 0.53
▸ MEN1 O00255 1/20 0.52
▸ PSMD14 O00487 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.52
▸ ALPL P05186 1/20 0.52
▸ POLB P06746 1/20 0.52
▸ MMP2 P08253 1/20 0.52
▸ ALPI P09923 1/20 0.52
▸ GAA P10253 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ ALPG P10696 1/20 0.52
▸ THRB P10828 1/20 0.52
▸ HTT P42858 1/20 0.52

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
SCHEMBL13499577 0.88 NAT1 (0.64) PTP4A3NAT1CRHBPCRHR2PIM1
SCHEMBL18102940 0.86 NAT1 (0.66) PTP4A3NAT1CRHBPCRHR2PIM1
SCHEMBL13499559 0.86 PTP4A3 (0.67) PTP4A3NAT1CRHBPCRHR2PIM1
SCHEMBL13499560 0.84 PTP4A3 (0.65) PTP4A3NAT1CRHBPCRHR2PIM1
SCHEMBL3405858 0.83 PTP4A3 (0.71) PTP4A3NAT1CRHBPCRHR2PIM1
SCHEMBL13616173 0.83 PTP4A3 (0.71) PTP4A3NAT1CRHBPCRHR2PIM1
SCHEMBL3405860 0.83 PTP4A3 (0.71) PTP4A3NAT1CRHBPCRHR2PIM1
SCHEMBL28964144 0.80 PTP4A3 (1.00) PTP4A3NAT1MYCMAXCA2
SCHEMBL8310654 0.78 NAT1 (1.00) NAT1CRHBPCRHR2PIM1MYC
SCHEMBL9427043 0.78 NAT1 (1.00) NAT1CRHBPCRHR2PIM1MYC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8431376-B2 Bacterial replication systems and methods THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2013-04-30 — — US disclosed
US-8431376-B2 Bacterial replication systems and methods THE REGENTS OF THE UNIVERSITY OF COLORADO (US) 2013-04-30 — — US disclosed
US-20100028862-A1 BACTERIAL REPLICATION SYSTEMS AND METHODS Replidyne,Inc. (US) 2010-02-04 — — US disclosed
US-20100028862-A1 BACTERIAL REPLICATION SYSTEMS AND METHODS Replidyne,Inc. (US) 2010-02-04 — — US disclosed
WO-2006071255-A9 BACTERIAL REPLICATION SYSTEMS AND METHODS REPLIDYNE INC (US) 2007-02-15 — — WO disclosed
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