SCHEMBL6901293

SCHEMBL6901293

CS(=O)(=O)Oc1ccc(Cl)c(CBr)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
ALPL P05186 1/20 0.40
ALPI P09923 1/20 0.40
KDM4E B2RXH2 4/20 0.39
PPARA Q07869 1/20 0.38
HPGD P15428 1/20 0.38
GAA P10253 2/20 0.37
CA2 P00918 5/20 0.37
CA12 O43570 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CA5A P35218 2/20 0.36
APEX1 P27695 1/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP7 P09237 1/20 0.35
MMP9 P14780 1/20 0.35
MMP14 P50281 1/20 0.35
HTR2A P28223 1/20 0.35
SLC6A4 P31645 1/20 0.35
KCNH2 Q12809 1/20 0.35

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
SCHEMBL29497677 0.84 ALDH1A1 (0.44) ALDH1A1ALPLALPIKDM4EHPGD
SCHEMBL20582868 0.84 ALDH1A1 (0.44) ALDH1A1ALPLALPIKDM4EHPGD
SCHEMBL2296280 0.81 ALDH1A1 (0.41) ALDH1A1ALPLALPIKDM4EHPGD
SCHEMBL7248921 0.78 TDP1 (0.55) ALDH1A1ALPLALPIGAACA2
SCHEMBL3487315 0.77 LMNA (0.50) ALDH1A1GAA
SCHEMBL474102 0.77 HTR2A (0.46) ALDH1A1HTR2ASLC6A4KCNH2
SCHEMBL24987673 0.76 KDM4E (0.43) ALDH1A1ALPLALPIKDM4EPPARA
SCHEMBL6905828 0.75 ALDH1A1 (0.49) ALDH1A1ALPLALPIKDM4EHPGD
SCHEMBL2761579 0.75 KDM4E (0.39) ALDH1A1ALPLALPIKDM4EPPARA
SCHEMBL137921 0.75 PPARA (0.43) ALDH1A1ALPLALPIKDM4EPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040110764-A1 Inhibitors of prenyl-protein transferase STUMP CRAIG A (US) 2004-06-10 US disclosed
US-6534506-B2 For therapy of cancer, neurofibromin benign proliferative disorder; blindness related to retinal vascularization; infections from hepatitis delta and related viruses; prophylaxis of restenosis; polycystic kidney disease MERCK & CO., INC. 2003-03-18 US disclosed
US-20020123497-A1 Inhibitors of prenyl-protein transferase MERCK SHARP & DOHME CORP. 2002-09-05 US disclosed
WO-2001077116-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-10-18 WO disclosed
WO-2001076693-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-10-18 WO 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 (2 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-20020123497-A1 Inhibitors of prenyl-protein transferase FNTA, KRAS, NRAS ALDH1A1 3836/4885ALPL 3387/4885ALPI 3013/4885
US-20040110764-A1 Inhibitors of prenyl-protein transferase FNTA, KRAS, PTAR1 ALDH1A1 3634/4885ALPL 3427/4885ALPI 2941/4885

“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.