SCHEMBL2568313

SCHEMBL2568313

COc1cc(C)c(S(=O)(=O)N2CCCCC2COCC(=O)Nc2cccc(N3CCOCC3)c2)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPT P10636 9/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.41
RAB9A P51151 2/20 0.41
POLB P06746 5/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
DRD4 P21917 1/20 0.40
NPC1 O15118 1/20 0.40
MAPK1 P28482 2/20 0.40
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39

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
SCHEMBL2568309 0.94 MAPT (0.47) ALDH1A1MAPTALOX15TSHRKDM4E
SCHEMBL2572091 0.92 MAPT (0.51) ALDH1A1LMNASMN1; SMN2MAPTALOX15
SCHEMBL2564993 0.88 MEN1 (0.41) ALDH1A1MAPTKDM4EPOLBMEN1
SCHEMBL2569313 0.88 MAPT (0.51) ALDH1A1MAPTALOX15KDM4ERAB9A
SCHEMBL2568639 0.85 WNT3A (0.43) ALDH1A1SMN1; SMN2MAPTKDM4ERAB9A
SCHEMBL2568344 0.85 MAPT (0.56) ALDH1A1LMNASMN1; SMN2MAPTTSHR
SCHEMBL2565831 0.85 POLB (0.46) ALDH1A1MAPTRAB9APOLB
SCHEMBL2568597 0.83 ACKR3 (0.47) RAB9A
SCHEMBL2571967 0.83 ALDH1A1 (0.43) ALDH1A1LMNASMN1; SMN2MAPTTSHR
SCHEMBL2565909 0.82 POLB (0.47) ALDH1A1MAPTTSHRKDM4ERAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2383267-A1 Substituted sulfonamide derivatives Grünenthal GmbH (DE) 2011-11-02 EP claimed
US-20100317644-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2010-12-16 US claimed
US-20080153843-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS GRUENENTHAL GMBH (DE) 2008-06-26 US claimed
US-8435978-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-05-07 US disclosed
EP-2383267-A1 Substituted sulfonamide derivatives Grünenthal GmbH (DE) 2011-11-02 EP disclosed
US-20100324009-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2010-12-23 US disclosed
US-20100317644-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2010-12-16 US disclosed
US-20080153843-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS GRUENENTHAL GMBH (DE) 2008-06-26 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 (3 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-20100317644-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 ALDH1A1 1535/4885LMNA 2964/4885SMN1; SMN2 45/4885
US-20100324009-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 ALDH1A1 1535/4885LMNA 2964/4885SMN1; SMN2 45/4885
US-20080153843-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS SULT2A1, STS, SULT1A1 ALDH1A1 1535/4885LMNA 2964/4885SMN1; SMN2 45/4885

“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.