SCHEMBL6808035

SCHEMBL6808035

CS(=O)(=O)c1ccccc1-c1ccc(OCC(=O)Nc2cccc(C#N)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.56
LMNA P02545 2/20 0.52
MAPK1 P28482 2/20 0.52
KCNH2 Q12809 1/20 0.52
F10 P00742 1/20 0.52
PRSS1 P07477 1/20 0.52
TP53 P04637 2/20 0.49
POLB P06746 1/20 0.49
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
HTT P42858 1/20 0.48
ALDH1A1 P00352 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
HPGD P15428 1/20 0.47
HIF1A Q16665 1/20 0.47
EPAS1 Q99814 1/20 0.47
MAPT P10636 2/20 0.47

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
SCHEMBL6801213 0.84 SMN1; SMN2 (0.54) MAPK1F10PRSS1TP53MEN1
SCHEMBL6804794 0.84 F10 (0.59) MAPK1F10PRSS1TP53POLB
SCHEMBL6805032 0.82 F10 (0.70) F10PRSS1ALDH1A1HIF1AEPAS1
SCHEMBL6808404 0.78 HAVCR2 (0.60) GAALMNAMAPK1TP53MEN1
SCHEMBL7076844 0.77 F10 (0.47) GAAF10PRSS1MEN1KMT2A
SCHEMBL6296950 0.77 F10 (0.85) F10PRSS1
SCHEMBL6808033 0.75 LMNA (0.52) GAALMNAMAPK1POLBMEN1
SCHEMBL6809507 0.75 SMN1; SMN2 (0.73) GAALMNAMAPK1KCNH2TP53
SCHEMBL6808855 0.74 ALOX15 (0.53) GAALMNAMEN1KMT2ANPC1
SCHEMBL7002197 0.74 F10 (0.47) F10PRSS1MEN1KMT2ANPC1

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-20040092517-A1 Phenyl derivatives and their use in the treatment of thromboembolic disorders or tumours MERCK PATENT GMBH (DE) 2004-05-13 US claimed
US-20040092517-A1 Phenyl derivatives and their use in the treatment of thromboembolic disorders or tumours MERCK PATENT GMBH (DE) 2004-05-13 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-20040092517-A1 Phenyl derivatives and their use in the treatment of thromboembolic disorders or tumours RCOR3, F2, NCOR2 GAA 4543/4885LMNA 436/4885MAPK1 2772/4885

“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.