SCHEMBL4907398

SCHEMBL4907398

CCN(Oc1ccc(C2CCCCC2)cc1)S(=O)(=O)c1ccc(C)c(C(=O)OC)c1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
TSHR P16473 3/20 0.42
CAMK2A Q9UQM7 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
HTT P42858 1/20 0.39
YAP1 P46937 1/20 0.39
STAT3 P40763 5/20 0.39
RORC P51449 1/20 0.38
MAPT P10636 1/20 0.38
ATM Q13315 1/20 0.38
KMT2A Q03164 2/20 0.38

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
SCHEMBL4903050 0.90 STAT3 (0.43) TSHRCAMK2ASTAT3
SCHEMBL4902618 0.81 ALDH1A1 (0.46) ALDH1A1TSHRSMN1; SMN2MAPTKMT2A
SCHEMBL4906721 0.81 ALDH1A1 (0.46) ALDH1A1TSHRSMN1; SMN2MAPTKMT2A
SCHEMBL4903045 0.79 ALDH1A1 (0.53) ALDH1A1TSHRSMN1; SMN2MAPTKMT2A
SCHEMBL4907392 0.78 TDP1 (0.47) ALDH1A1TSHRSMN1; SMN2TDP1HTT
SCHEMBL4909548 0.78 MMP9 (0.48) ALDH1A1TSHRSMN1; SMN2MAPTKMT2A
SCHEMBL4911887 0.73 ALDH1A1 (0.39) ALDH1A1TSHRSMN1; SMN2TDP1HTT
SCHEMBL4900736 0.72 TSHR (0.39) ALDH1A1TSHRSMN1; SMN2TDP1HTT
SCHEMBL4899484 0.72 ALDH1A1 (0.39) ALDH1A1TSHRSMN1; SMN2MAPTKMT2A
SCHEMBL4899843 0.71 LMNA (0.44) ALDH1A1SMN1; SMN2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PFIZER INC. 2008-04-17 US disclosed
US-20060229363-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds HAMANAKA ERNEST S 2006-10-12 US disclosed
US-20050288340-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PFIZER INC 2005-12-29 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-20060229363-A1 Substituted Heteroaryl- and Phenylsulfamoyl Compounds PPARA, PPARG, PPARD ALDH1A1 2664/4885TSHR 412/4885CAMK2A 2334/4885
US-20050288340-A1 Substituted heteroaryl- and phenylsulfamoyl compounds PPARA, PPARG, PPARD ALDH1A1 2956/4885TSHR 400/4885CAMK2A 2101/4885
US-20080090829-A1 SUBSTITUTED HETEROARYL- AND PHENYLSULFAMOYL COMPOUNDS PPARA, PPARG, PPARD ALDH1A1 2956/4885TSHR 400/4885CAMK2A 2101/4885

“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.