SCHEMBL6401348

SCHEMBL6401348

CCC(C)[C@H](NC(=O)N1CCN(C)CC1)C(=O)N(CCCc1ccccc1)C(c1ccc(OC)cc1)S(N)(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
SIGMAR1 Q99720 1/20 0.38
CHRM5 P08912 1/20 0.38
CHRM1 P11229 1/20 0.38
CHRM3 P20309 1/20 0.38
PKM P14618 1/20 0.37
LMNA P02545 1/20 0.36
OPRM1 P35372 2/20 0.36
ALDH1A1 P00352 1/20 0.36
MMP1 P03956 1/20 0.36
MMP9 P14780 1/20 0.36
MMP13 P45452 1/20 0.36
ADAM17 P78536 1/20 0.36
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36
CTSS P25774 1/20 0.36
LPAR1 Q92633 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
SCHEMBL6401353 0.81 MEN1 (0.40) KMT2AMEN1SIGMAR1CHRM5CHRM1
SCHEMBL5443504 0.77 CTSS (0.47) MMP1MMP9MMP13CTSLCTSB
SCHEMBL6404630 0.71 L3MBTL1 (0.44) KMT2AMEN1ALDH1A1MMP1
SCHEMBL7258293 0.71 L3MBTL1 (0.44) KMT2AMEN1ALDH1A1MMP1
SCHEMBL6401355 0.70 CTSS (0.41) KMT2AALDH1A1MMP13CTSLCTSB
SCHEMBL6401314 0.70 CTSS (0.42) KMT2ASIGMAR1LMNAALDH1A1CTSL
SCHEMBL6408723 0.69 CA1 (0.41) KMT2AMEN1CHRM5CHRM1CHRM3
SCHEMBL6405204 0.69 CTSS (0.40) LMNAALDH1A1MMP1CTSLCTSS
SCHEMBL6408935 0.69 LMNA (0.44) KMT2ALMNAALDH1A1CTSLCTSS
SCHEMBL6401370 0.68 L3MBTL1 (0.40) KMT2AMEN1ALDH1A1MMP1

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-6900237-B2 Sulfonamide compounds as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-05-31 US claimed
US-20030158231-A1 Sulfonamide compounds as protease inhibitors Celera Corporation 2003-08-21 US claimed
US-6900237-B2 Sulfonamide compounds as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-05-31 US disclosed
US-20030158231-A1 Sulfonamide compounds as protease inhibitors Celera Corporation 2003-08-21 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-20030158231-A1 Sulfonamide compounds as protease inhibitors PRSS1, PRSS3, SPINT2 KMT2A 2789/4885MEN1 4533/4885SIGMAR1 2372/4885

“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.