SCHEMBL6767804

SCHEMBL6767804

Cc1ccc(NS(=O)(=O)c2c(C)c(C)cc(C)c2C)cc1NC(=O)Cc1ccc(C(=N)N)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.54
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
F2 P00734 12/20 0.41
PRSS1 P07477 10/20 0.41
PRSS2 P07478 10/20 0.41
PRSS3 P35030 10/20 0.41
NPC1 O15118 1/20 0.41
SELL P14151 1/20 0.40
SELP P16109 1/20 0.40
F10 P00742 1/20 0.39
PLG P00747 1/20 0.39
PLAU P00749 1/20 0.39
PLAT P00750 1/20 0.39
KLK1 P06870 1/20 0.39
KLK5 Q9Y337 1/20 0.39

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
SCHEMBL6765424 0.86 F2 (0.55) F2PRSS1PRSS2PRSS3F10
SCHEMBL6765892 0.83 ALDH1A1 (0.50) SMN1; SMN2MAPK1MEN1KMT2AF2
SCHEMBL6574325 0.83 LMNA (0.44) SMN1; SMN2LMNAGAAMAPK1HTT
SCHEMBL6766786 0.82 F2 (0.60) HTTF2PRSS1PRSS2PRSS3
SCHEMBL6764616 0.81 SLC22A12 (0.44) F2PRSS1PRSS2PRSS3
SCHEMBL6762119 0.80 TMPRSS6 (0.57) LMNAF2PRSS1PRSS2PRSS3
SCHEMBL6765337 0.79 F2 (0.52) F2PRSS1PRSS2PRSS3PLAU
SCHEMBL6764538 0.79 F2 (0.43) SMN1; SMN2LMNAGAAMAPK1MEN1
SCHEMBL6771025 0.78 F2 (0.55) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL6762034 0.76 F2 (0.41) LMNAF2PRSS1PRSS2PRSS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040248897-A1 Substituted N-acylaniline derivatives, the preparation thereof, and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-12-09 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-20040248897-A1 Substituted N-acylaniline derivatives, the preparation thereof, and their use as pharmaceutical compositions NAT1, CYP3A5, CYP3A7 SMN1; SMN2 2628/4885LMNA 1447/4885GAA 454/4885

“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.