SCHEMBL2566400

SCHEMBL2566400

O=C(COCC1CCCCN1S(=O)(=O)c1c(Cl)cccc1Cl)N1CCCC1Cc1ccccn1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 1/20 0.40
EGFR P00533 2/20 0.38
ERBB2 P04626 2/20 0.38
ALDH1A1 P00352 3/20 0.37
POLB P06746 1/20 0.37
TP53 P04637 1/20 0.36
LMNA P02545 1/20 0.36
GLA P06280 1/20 0.36
PKM P14618 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CCKAR P32238 1/20 0.36
CPT2 P23786 3/20 0.36
CPT1A P50416 3/20 0.36
ATM Q13315 1/20 0.36
CPT1B Q92523 1/20 0.36
FKBP1A P62942 1/20 0.36

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
SCHEMBL2564083 0.88 TP53 (0.35) RAB9AALDH1A1TP53LMNAHTT
SCHEMBL2569764 0.87 KMT2A (0.44) RAB9AALDH1A1LMNAGLAPKM
SCHEMBL2570935 0.87 TP53 (0.36) RAB9AALDH1A1TP53LMNAHTT
SCHEMBL2566344 0.86 PAX8 (0.41) ATMFKBP1A
SCHEMBL2570278 0.85 RAB9A (0.41) RAB9AALDH1A1POLBLMNASMN1; SMN2
SCHEMBL2567373 0.84 RORC (0.36) RAB9AALDH1A1TP53LMNAHTT
SCHEMBL2565910 0.83 RAB9A (0.41) RAB9AALDH1A1POLB
SCHEMBL2564465 0.81 KDM4E (0.50) RAB9AALDH1A1LMNAHTTSMN1; SMN2
SCHEMBL2570824 0.80 POLB (0.46) ALDH1A1POLBLMNAHTT
SCHEMBL5132594 0.78 ATM (0.46) ATMFKBP1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2066659-B1 SUBSTITUTED SULFONAMIDE DERIVATIVES GRUENENTHAL GMBH (DE) 2013-08-28 EP claimed
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
EP-2066659-B1 SUBSTITUTED SULFONAMIDE DERIVATIVES GRUENENTHAL GMBH (DE) 2013-08-28 EP disclosed
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 RAB9A 2794/4885EGFR 2881/4885ERBB2 2180/4885
US-20100324009-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 RAB9A 2794/4885EGFR 2881/4885ERBB2 2180/4885
US-20080153843-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS SULT2A1, STS, SULT1A1 RAB9A 2794/4885EGFR 2881/4885ERBB2 2180/4885

“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.