SCHEMBL501925

SCHEMBL501925

CCN1CCN(C(=S)Nc2ccc(Cl)c(Cl)c2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 9/20 1.00
SMN1; SMN2 Q16637 3/20 0.72
NPSR1 Q6W5P4 1/20 0.72
ALDH1A1 P00352 3/20 0.62
HPGD P15428 1/20 0.62
DUSP3 P51452 1/20 0.62
PTPN5 P54829 1/20 0.62
PTPN11 Q06124 1/20 0.62
MAPT P10636 2/20 0.58
POLB P06746 1/20 0.57
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
PTPN7 P35236 1/20 0.55
HTT P42858 1/20 0.55
KDM4E B2RXH2 1/20 0.54
GAA P10253 1/20 0.54
CCR2 P41597 2/20 0.52
KCNH2 Q12809 2/20 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
SCHEMBL14119622 0.90 LMNA (0.82) LMNASMN1; SMN2NPSR1ALDH1A1MAPT
SCHEMBL501804 0.84 LMNA (1.00) LMNASMN1; SMN2ALDH1A1MAPTMEN1
SCHEMBL14119589 0.82 LMNA (0.73) LMNASMN1; SMN2NPSR1ALDH1A1HPGD
SCHEMBL14119869 0.81 LMNA (0.73) LMNASMN1; SMN2ALDH1A1HPGDMAPT
SCHEMBL14119898 0.78 LMNA (1.00) LMNASMN1; SMN2NPSR1ALDH1A1MAPT
SCHEMBL1943283 0.78 CCR2 (0.77) LMNASMN1; SMN2ALDH1A1CCR2KCNH2
SCHEMBL14119465 0.77 MAPT (0.70) LMNASMN1; SMN2NPSR1ALDH1A1DUSP3
SCHEMBL14120354 0.75 ALDH1A1 (0.70) LMNASMN1; SMN2ALDH1A1MAPTMEN1
SCHEMBL1945674 0.74 CCR2 (0.77) LMNACCR2KCNH2
SCHEMBL20236859 0.72 MAPT (0.71) LMNASMN1; SMN2HPGDMAPTCCR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8106058-B2 Anti-arenaviral compounds SIGA TECHNOLOGIES, INC. (US) 2012-01-31 US claimed
US-8791110-B2 Anti-arenaviral compounds SIGA TECHNOLOGIES, INC. (US) 2014-07-29 US disclosed
US-8791110-B2 Anti-arenaviral compounds SIGA TECHNOLOGIES, INC. (US) 2014-07-29 US disclosed
US-8518951-B2 Anti-arenaviral compounds SIGA TECHNOLOGIES, INC. (US) 2013-08-27 US disclosed
US-8518951-B2 Anti-arenaviral compounds SIGA TECHNOLOGIES, INC. (US) 2013-08-27 US disclosed
US-20120308519-A1 Anti-Arenaviral Compounds SIGA TECHNOLOGIES, INC. (US) 2012-12-06 US disclosed
US-20120308519-A1 Anti-Arenaviral Compounds SIGA TECHNOLOGIES, INC. (US) 2012-12-06 US disclosed
US-20120107276-A1 Anti-Arenaviral Compounds SIGA TECHNOLOGIES, INC. (US) 2012-05-03 US disclosed
US-20120107276-A1 Anti-Arenaviral Compounds SIGA TECHNOLOGIES, INC. (US) 2012-05-03 US disclosed
US-8106058-B2 Anti-arenaviral compounds SIGA TECHNOLOGIES, INC. (US) 2012-01-31 US disclosed
US-8106058-B2 Anti-arenaviral compounds SIGA TECHNOLOGIES, INC. (US) 2012-01-31 US disclosed
US-8106058-B2 Anti-arenaviral compounds SIGA TECHNOLOGIES, INC. (US) 2012-01-31 US disclosed
US-20090180980-A1 Anti-Arenaviral Compunds SIGA TECHNOLOGIES, INC. (US) 2009-07-16 US disclosed
US-20090180980-A1 Anti-Arenaviral Compunds SIGA TECHNOLOGIES, INC. (US) 2009-07-16 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 (3 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-20120107276-A1 Anti-Arenaviral Compounds ZC3HAV1, CNBP, EIF2AK2 LMNA 2616/4885SMN1; SMN2 1463/4885NPSR1 3018/4885
US-20090180980-A1 Anti-Arenaviral Compunds ZC3HAV1, EIF2AK2, CNBP LMNA 2806/4885SMN1; SMN2 1200/4885NPSR1 2301/4885
US-20120308519-A1 Anti-Arenaviral Compounds ZC3HAV1, CNBP, EIF2AK2 LMNA 2616/4885SMN1; SMN2 1463/4885NPSR1 3018/4885

“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.