SCHEMBL5860258

SCHEMBL5860258

O=c1cc(C(F)(F)F)c2cc(Cc3ccc(S(=O)(=O)NC4CCCC4)cc3)ccc2o1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.44
KDM4E B2RXH2 1/20 0.44
RECQL P46063 1/20 0.44
ALDH1A1 P00352 8/20 0.42
LMNA P02545 5/20 0.41
TSHR P16473 2/20 0.41
HPGD P15428 2/20 0.41
CYP3A4 P08684 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
GAA P10253 2/20 0.38
AR P10275 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
MAPT P10636 1/20 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
SCHEMBL5860196 0.99 ALDH1A1 (0.44) SMN1; SMN2KDM4ERECQLALDH1A1LMNA
SCHEMBL5759747 0.91 KMT2A (0.37) KDM4EALDH1A1LMNAHPGDCYP3A4
SCHEMBL5762299 0.86 HDAC4 (0.46) SMN1; SMN2ALDH1A1LMNATSHRMAPK1
SCHEMBL5759681 0.86 MAOB (0.53) SMN1; SMN2ALDH1A1HTTMAPT
SCHEMBL5762163 0.83 SCN9A (0.38) KDM4EALDH1A1LMNAHPGDCYP3A4
SCHEMBL5761768 0.82 KCNA5 (0.53) KDM4EALDH1A1LMNAHPGDCYP3A4
SCHEMBL5762790 0.82 ALDH1A1 (0.44) SMN1; SMN2KDM4EALDH1A1LMNATSHR
SCHEMBL5757048 0.81 MAPT (0.46) SMN1; SMN2KDM4EALDH1A1LMNATSHR
SCHEMBL5761750 0.80 KDM4E (0.46) KDM4EALDH1A1LMNAHPGDCYP3A4
SCHEMBL5760140 0.80 MCL1 (0.47) KDM4EALDH1A1HPGDGAAAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7098340-B2 Quinoline/chromene derivatives as androgen antagonist WARNER LAMBERT COMPANY LLC (US) 2006-08-29 US claimed
US-20050137228-A1 Benzyl sulfonamide derivatives DU DANIEL Y (US) 2005-06-23 US claimed
US-7098340-B2 Quinoline/chromene derivatives as androgen antagonist WARNER LAMBERT COMPANY LLC (US) 2006-08-29 US disclosed
US-20050137228-A1 Benzyl sulfonamide derivatives DU DANIEL Y (US) 2005-06-23 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-20050137228-A1 Benzyl sulfonamide derivatives AR, SHBG, BRDT SMN1; SMN2 3908/4885KDM4E 870/4885RECQL 1484/4885

“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.