SCHEMBL4299461

SCHEMBL4299461

O=C(COCC1COc2ccccc2N1S(=O)(=O)c1ccccc1C(F)(F)F)N1CCC(OCCN2CCCC2)(c2ccncc2)CC1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
PKM P14618 1/20 0.34
KMT2A Q03164 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.32
MDM2 Q00987 4/20 0.31
TP53 P04637 3/20 0.31
CYP3A4 P08684 2/20 0.31
CACNA1B Q00975 2/20 0.31
GFER P55789 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
WNT3 P56703 1/20 0.30
SFRP1 Q8N474 1/20 0.30
PTGDR2 Q9Y5Y4 1/20 0.30
TIPARP Q7Z3E1 1/20 0.30
TACR1 P25103 1/20 0.30

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
SCHEMBL4300130 0.93 LMNA (0.33) LMNAPKMKMT2ANPC1POLB
SCHEMBL4298342 0.90 LMNA (0.35) LMNAPKMNPC1POLBCACNA1B
SCHEMBL700983 0.89 LMNA (0.34) LMNAPKMKMT2ANPC1POLB
SCHEMBL4299654 0.84 NPC1 (0.40) LMNANPC1POLBCYP3A4
SCHEMBL701062 0.83 TACR1 (0.34) LMNAPKMKMT2ANPC1POLB
SCHEMBL3441795 0.78 KCNQ1 (0.34) KMT2AWNT3SFRP1TIPARPTACR1
SCHEMBL3441798 0.78 KCNQ1 (0.34) KMT2AWNT3SFRP1TIPARPTACR1
SCHEMBL4299141 0.78 NPC1 (0.38) LMNANPC1
SCHEMBL4302525 0.76 NPC1 (0.39) LMNAKMT2ANPC1
SCHEMBL700177 0.75 NPC1 (0.43) LMNAPKMKMT2ANPC1POLB

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-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-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 (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-20090264400-A1 Substituted Sulfonamide Compounds BDKRB1, BDKRB2, TRPV1 LMNA 2572/4885PKM 910/4885KMT2A 2533/4885

“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.