SCHEMBL3634464

SCHEMBL3634464

COc1ccc(S(=O)(=O)N(c2ccccc2)C2CCN(C(=O)OC[C@@H](Cc3ccccc3)N(Cc3ccccc3)Cc3ccccc3)CC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ TAS2R14 Q9NYV8 6/20 0.45
▸ PTGES O14684 2/20 0.45
▸ TAS2R8 Q9NYW2 1/20 0.45
▸ CXCR3 P49682 1/20 0.45
▸ MMP8 P22894 5/20 0.43
▸ MMP13 P45452 5/20 0.43
▸ MMP1 P03956 5/20 0.43
▸ MMP9 P14780 5/20 0.43
▸ MMP2 P08253 4/20 0.43
▸ MMP3 P08254 4/20 0.43
▸ MMP7 P09237 4/20 0.43
▸ TSHR P16473 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ KCNA5 P22460 1/20 0.42
▸ CHRM2 P08172 1/20 0.42
▸ CHRM1 P11229 1/20 0.42
▸ CHRM5 P08912 1/20 0.41

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
SCHEMBL3634460 1.00 MEN1 (0.47) MEN1LMNAKMT2ATAS2R14PTGES
SCHEMBL3635250 0.90 LMNA (0.51) MEN1LMNAKMT2ATAS2R14PTGES
SCHEMBL3746742 0.89 HPGD (0.41) MEN1KMT2A
SCHEMBL3634404 0.89 HPGD (0.41) MEN1KMT2A
SCHEMBL3632109 0.85 TSHR (0.46) LMNATAS2R14PTGESTAS2R8CXCR3
SCHEMBL3636191 0.83 LMNA (0.42) MEN1LMNAKMT2ATSHRMAPK1
SCHEMBL3750658 0.83 HTR2A (0.39) MMP8MMP13MMP1MMP2MMP3
SCHEMBL3639167 0.83 HTR2A (0.39) MMP8MMP13MMP1MMP2MMP3
SCHEMBL3631393 0.81 MMP8 (0.42) MEN1LMNAKMT2APTGESMMP8
SCHEMBL3631395 0.81 MMP8 (0.42) MEN1LMNAKMT2APTGESMMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100292214-A1 Compounds with Antiparasitic Activity, Applications thereof to the Treatment of Infectious Diseases Caused by Apicomplexans COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2010-11-18 — — US claimed
US-20100292214-A1 Compounds with Antiparasitic Activity, Applications thereof to the Treatment of Infectious Diseases Caused by Apicomplexans COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2010-11-18 — — US disclosed
EP-2155676-A2 COMPOUNDS WITH ANTIPARASITIC ACTIVITY, APPLICATIONS THEREOF TO THE TREATMENT OF INFECTIOUS DISEASES CAUSED BY APICOMPLEXANS Commissariat à l'Energie Atomique (FR) 2010-02-24 — — EP disclosed
WO-2008146172-A2 COMPOUNDS WITH ANTIPARASITIC ACTIVITY, APPLICATIONS THEREOF TO THE TREATMENT OF INFECTIOUS DISEASES CAUSED BY APICOMPLEXANS COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 2008-12-04 — — 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 (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-20100292214-A1 Compounds with Antiparasitic Activity, Applications thereof to the Treatment of Infectious Diseases Caused by Apicomplexans ABCB11, TPP1, ABCB1 MEN1 2707/4885LMNA 3040/4885KMT2A 4004/4885

“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.

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