SCHEMBL700983

SCHEMBL700983

O=C(COCC1COc2ccccc2N1S(=O)(=O)c1ccccc1C(F)(F)F)N1CCC(CCCN2CCCC2)(c2ccncc2)CC1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.34
PKM P14618 1/20 0.34
TACR1 P25103 2/20 0.33
KMT2A Q03164 1/20 0.33
CACNA1B Q00975 4/20 0.32
POLB P06746 1/20 0.32
CCR5 P51681 2/20 0.32
CCR1 P32246 1/20 0.32
NPC1 O15118 1/20 0.31
GFER P55789 1/20 0.31
TP53 P04637 1/20 0.31
MDM2 Q00987 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PTGDR2 Q9Y5Y4 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
SCHEMBL701062 0.93 TACR1 (0.34) LMNAPKMTACR1KMT2ACACNA1B
SCHEMBL4299461 0.89 LMNA (0.34) LMNAPKMTACR1KMT2ACACNA1B
SCHEMBL702140 0.85 KMT2A (0.37) TACR1KMT2APOLBCCR5CCR1
SCHEMBL701011 0.84 NPC1 (0.38) LMNAPOLBNPC1L3MBTL1
SCHEMBL4300130 0.83 LMNA (0.33) LMNAPKMTACR1KMT2ACACNA1B
SCHEMBL4298342 0.80 LMNA (0.35) LMNAPKMTACR1CACNA1BPOLB
SCHEMBL703365 0.78 TACR1 (0.36) TACR1KMT2ACCR5CCR1
SCHEMBL702190 0.78 NPC1 (0.37) LMNANPC1
SCHEMBL700168 0.77 ADAMTS5 (0.33) CCR1NPC1
SCHEMBL701483 0.76 HTR7 (0.40) TACR1KMT2ACCR5CCR1GFER

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124624-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-02-28 US claimed
EP-2262791-A2 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2010-12-22 EP claimed
US-20090264407-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-22 US claimed
WO-2009124734-A2 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2009-10-15 WO claimed
US-8124624-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-02-28 US disclosed
US-20090264407-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-20090264407-A1 Substituted Sulfonamide Compounds CNR1, SUCNR1, OPRL1 LMNA 2119/4885PKM 1715/4885TACR1 18/4885

“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.