SCHEMBL4293128

SCHEMBL4293128

O=C(CC1COc2ccccc2N1S(=O)(=O)c1ccc(Cl)cc1Cl)N1CCC(OCCN2CCCC2)(c2cccc(F)c2)CC1

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.34
PSEN1 P49768 3/20 0.32
PSEN2 P49810 3/20 0.32
APH1B Q8WW43 3/20 0.32
NCSTN Q92542 3/20 0.32
APH1A Q96BI3 3/20 0.32
PSENEN Q9NZ42 3/20 0.32
RORC P51449 2/20 0.32
HTR7 P34969 1/20 0.32
CCR5 P51681 3/20 0.32
CACNA1B Q00975 2/20 0.31
APP P05067 1/20 0.31
BDKRB1 P46663 1/20 0.31
POLB P06746 1/20 0.31
KIF11 P52732 1/20 0.31
KCNH2 Q12809 1/20 0.31
AVPR1A P37288 1/20 0.31
AVPR1B P47901 1/20 0.31

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
SCHEMBL4294660 0.82 NPC1 (0.33) NPC1PSEN1PSEN2APH1BNCSTN
SCHEMBL4298342 0.81 LMNA (0.35) NPC1RORCCACNA1BPOLB
SCHEMBL4302525 0.79 NPC1 (0.39) NPC1BDKRB1
SCHEMBL13673260 0.75 KMT2A (0.40) NPC1
SCHEMBL4295681 0.72 NPC1 (0.48) NPC1BDKRB1POLB
SCHEMBL4299461 0.71 LMNA (0.34) NPC1CACNA1BPOLB
SCHEMBL4300130 0.71 LMNA (0.33) NPC1CACNA1BPOLB
SCHEMBL13660737 0.70 NPC1 (0.53) NPC1BDKRB1POLB
SCHEMBL4296281 0.70 PSEN1 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3441825 0.70 MEN1 (0.44) CCR5POLB

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-8318769-B2 Substituted sulfonamide compounds GRUENETHAL GMBH (DE) 2012-11-27 US claimed
US-20090264400-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-22 US claimed
US-8318769-B2 Substituted sulfonamide compounds GRUENETHAL GMBH (DE) 2012-11-27 US disclosed
US-20090264428-A1 Renin Inhibitors VITAE PHARMACEUTICALS, INC. 2009-10-22 US disclosed
US-20090264400-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-22 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 (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-20090264428-A1 Renin Inhibitors REN, ACE, SERPINB1 NPC1 1140/4885PSEN1 437/4885PSEN2 815/4885
US-20090264400-A1 Substituted Sulfonamide Compounds BDKRB1, BDKRB2, TRPV1 NPC1 2705/4885PSEN1 990/4885PSEN2 1516/4885

“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.