SCHEMBL6765892

SCHEMBL6765892

Cc1cccc(S(=O)(=O)Nc2ccc(C)c(NC(=O)Cc3ccc(C(=N)N)cc3)c2)c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
MAPT P10636 1/20 0.50
HPGD P15428 1/20 0.50
F2 P00734 13/20 0.47
PRSS1 P07477 8/20 0.47
PRSS2 P07478 8/20 0.47
PRSS3 P35030 8/20 0.47
MAPK1 P28482 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
PKM P14618 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
MGAT2 Q10469 1/20 0.42

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 0.91 F2 (0.55) F2PRSS1PRSS2PRSS3MGAT2
SCHEMBL6762119 0.85 TMPRSS6 (0.57) ALDH1A1HPGDF2PRSS1PRSS2
SCHEMBL6571783 0.84 LMNA (0.51) ALDH1A1MAPTHPGDMAPK1SMN1; SMN2
SCHEMBL6767804 0.83 SMN1; SMN2 (0.54) MAPTF2PRSS1PRSS2PRSS3
SCHEMBL6771025 0.83 F2 (0.55) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL6766786 0.83 F2 (0.60) ALDH1A1F2PRSS1PRSS2PRSS3
SCHEMBL6765337 0.81 F2 (0.52) F2PRSS1PRSS2PRSS3
SCHEMBL6771080 0.81 F2 (0.51) F2PRSS1PRSS2PRSS3
SCHEMBL6764616 0.80 SLC22A12 (0.44) F2PRSS1PRSS2PRSS3
SCHEMBL6764877 0.79 F2 (0.57) F2PRSS1PRSS2PRSS3

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 ALDH1A1 669/4885MAPT 449/4885HPGD 2121/4885

“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.