SCHEMBL15097021

SCHEMBL15097021

O=C1NC(=S)S/C1=C\c1nc(C(F)(F)F)nc(C(F)(F)F)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MYC P01106 2/20 0.51
▸ MAX P61244 2/20 0.51
▸ CISD1 Q9NZ45 3/20 0.49
▸ PIM1 P11309 6/20 0.48
▸ PTP4A3 O75365 2/20 0.47
▸ NAT1 P18440 4/20 0.47
▸ MAOA P21397 1/20 0.47
▸ CA2 P00918 1/20 0.45
▸ EPHX1 P07099 1/20 0.45
▸ DNM1 Q05193 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ PSMD14 O00487 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ ALPL P05186 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ MMP2 P08253 1/20 0.43
▸ ALPI P09923 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ ALPG P10696 1/20 0.43

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
SCHEMBL15304596 0.90 MYC (0.46) MYCMAXCISD1PIM1PTP4A3
SCHEMBL14226374 0.76 ALDH1A1 (0.52) CISD1PIM1PTP4A3NAT1MAOA
SCHEMBL9428429 0.72 PTGS2 (0.56) MYCMAXCISD1PIM1PTP4A3
SCHEMBL9428425 0.72 PTGS2 (0.56) MYCMAXCISD1PIM1PTP4A3
SCHEMBL4085086 0.70 PIM1 (0.77) MYCMAXCISD1PIM1NAT1
SCHEMBL15091393 0.70 PIM1 (0.77) MYCMAXCISD1PIM1NAT1
SCHEMBL4085089 0.70 PIM1 (0.77) MYCMAXCISD1PIM1NAT1
SCHEMBL9405061 0.67 PTP4A3 (0.66) MYCMAXCISD1PIM1PTP4A3
SCHEMBL15097007 0.67 MYC (0.61) MYCMAXCISD1PIM1PTP4A3
SCHEMBL11083057 0.67 MEN1 (0.55) MYCMAXCISD1PIM1PTP4A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130177844-A1 CHARGE CONTROL AGENT AND TONER USING SAME HODOGAYA CHEMICAL CO., LTD. (JP) 2013-07-11 — — US disclosed
US-20130177844-A1 CHARGE CONTROL AGENT AND TONER USING SAME HODOGAYA CHEMICAL CO., LTD. (JP) 2013-07-11 — — US disclosed
Send feedback