SCHEMBL5011622

SCHEMBL5011622

Cc1cccc(S(=O)(=O)/N=C/N(C)C)c1C#N

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
GAA P10253 1/20 0.45
ALDH1A1 P00352 5/20 0.36
HTT P42858 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C19 P33261 1/20 0.36
PIK3CD O00329 1/20 0.34
PIK3CA P42336 1/20 0.34
MAPK1 P28482 2/20 0.34
TSHR P16473 1/20 0.34
KCNJ6 P48051 1/20 0.32
KCNJ5 P48544 1/20 0.32
KCNJ3 P48549 1/20 0.32
BCAT1 P54687 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
RECQL P46063 1/20 0.31
RAF1 P04049 1/20 0.31
KDM4E B2RXH2 3/20 0.30
ALOX15 P16050 2/20 0.30
NPC1 O15118 1/20 0.30

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
SCHEMBL5011626 1.00 LMNA (0.45) LMNAGAAALDH1A1HTTCYP1A2
SCHEMBL14529092 0.78 LMNA (0.49) LMNAGAAALDH1A1BCAT1KDM4E
SCHEMBL11095403 0.75 ALDH1A1 (0.57) LMNAALDH1A1HTTCYP1A2CYP2C19
SCHEMBL13082284 0.73 CYP1A2 (0.44) LMNAALDH1A1HTTCYP1A2CYP2C19
SCHEMBL5007590 0.72 F2 (0.40) LMNAGAAALDH1A1CYP1A2CYP2C19
SCHEMBL4972108 0.72 CYP1A2 (0.43) ALDH1A1HTTCYP1A2CYP2C19TSHR
SCHEMBL2431935 0.72 CYP1A2 (0.43) ALDH1A1HTTCYP1A2CYP2C19TSHR
SCHEMBL5009632 0.71 CYP1A2 (0.36) LMNACYP1A2CYP2C19KDM4ESLC22A12
SCHEMBL5007599 0.71 F2 (0.39) LMNAALDH1A1CYP1A2CYP2C19NPSR1
SCHEMBL5007593 0.71 F2 (0.39) LMNAALDH1A1CYP1A2CYP2C19NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080300280-A1 Cyanobenzene Compounds for Combating Animal Pests BASF SE (DE) 2008-12-04 US disclosed
US-20080300280-A1 Cyanobenzene Compounds for Combating Animal Pests BASF SE (DE) 2008-12-04 US disclosed
US-20080300280-A1 Cyanobenzene Compounds for Combating Animal Pests BASF SE (DE) 2008-12-04 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 (1 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-20080300280-A1 Cyanobenzene Compounds for Combating Animal Pests NR0B1, NR0B2, CBR1 LMNA 4546/4885GAA 4606/4885ALDH1A1 2218/4885

“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.