SCHEMBL6079459

SCHEMBL6079459

O=C(O)[C@@H]1CCCC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.58
LMNA P02545 5/20 0.58
GAA P10253 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
MAPK1 P28482 1/20 0.55
HTT P42858 2/20 0.55
MAPT P10636 1/20 0.55
CRHBP P24387 3/20 0.54
CRHR2 Q13324 3/20 0.54
MCOLN3 Q8TDD5 1/20 0.54
THRB P10828 1/20 0.52
HSP90AA1 P07900 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
KMT2A Q03164 2/20 0.50
KDM4E B2RXH2 1/20 0.50
TSHR P16473 1/20 0.50
POLB P06746 1/20 0.50
RAB9A P51151 1/20 0.50
TDP1 Q9NUW8 1/20 0.49

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
SCHEMBL6079023 1.00 ALDH1A1 (0.58) ALDH1A1LMNAGAASMN1; SMN2MAPK1
SCHEMBL6078369 1.00 ALDH1A1 (0.58) ALDH1A1LMNAGAASMN1; SMN2MAPK1
SCHEMBL6382811 1.00 ALDH1A1 (0.58) ALDH1A1LMNAGAASMN1; SMN2MAPK1
SCHEMBL372609 0.99 ALDH1A1 (0.56) ALDH1A1LMNAGAASMN1; SMN2MAPK1
SCHEMBL372675 0.97 ALDH1A1 (0.54) ALDH1A1LMNAGAASMN1; SMN2MAPK1
Hydrochloric Acid SCHEMBL492003 0.96 ALDH1A1 (0.53) ALDH1A1LMNAGAASMN1; SMN2MAPK1
SCHEMBL6078980 0.87 MAPK1 (0.54) ALDH1A1LMNAGAASMN1; SMN2MAPK1
SCHEMBL6078711 0.87 MAPK1 (0.54) ALDH1A1LMNAGAASMN1; SMN2MAPK1
SCHEMBL2202304 0.87 MAPK1 (0.57) ALDH1A1LMNAGAASMN1; SMN2MAPK1
SCHEMBL6078229 0.87 MAPK1 (0.54) ALDH1A1LMNAGAASMN1; SMN2MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7084178-B2 Antiamyloid phenylsulfonamides: N-cycloalkylcarboxamides derivatives BRISTOL-MYERS SQUIBB COMPANY (US) 2006-08-01 US disclosed
US-20050113442-A1 Antiamyloid phenylsulfonamides: N-cycloalkylcarboxamides derivatives BRISTOL-MYERS SQUIBB COMPANY 2005-05-26 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 (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-20050113442-A1 Antiamyloid phenylsulfonamides: N-cycloalkylcarboxamides derivatives APP, PSEN1, PSEN2 ALDH1A1 3997/4885LMNA 1191/4885GAA 317/4885

“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.