SCHEMBL5354487

SCHEMBL5354487

COC(=O)c1sccc1S(=O)(=O)NCCc1ccc(F)cc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.54
LMNA P02545 1/20 0.50
KCNH2 Q12809 1/20 0.48
CYP1A2 P05177 2/20 0.48
CYP2D6 P10635 2/20 0.48
CYP2C19 P33261 2/20 0.48
POLB P06746 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
EDNRA P25101 3/20 0.47
CYP2C9 P11712 1/20 0.46
MAPT P10636 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
PKM P14618 1/20 0.44
TAAR1 Q96RJ0 1/20 0.44

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
SCHEMBL5356271 0.86 TAAR1 (0.50) ALDH1A1LMNACYP1A2CYP2D6CYP2C19
SCHEMBL5354260 0.82 KCNH2 (0.45) ALDH1A1LMNAKCNH2CYP1A2CYP2D6
SCHEMBL5356350 0.80 LMNA (0.54) ALDH1A1LMNAKCNH2CYP1A2CYP2D6
SCHEMBL12293577 0.79 MAPT (0.65) ALDH1A1LMNAKCNH2CYP1A2CYP2D6
SCHEMBL5358993 0.78 KCNH2 (0.41) ALDH1A1LMNAKCNH2CYP1A2CYP2D6
SCHEMBL19002773 0.77 EDNRA (0.50) ALDH1A1LMNACYP1A2CYP2C19POLB
SCHEMBL19002770 0.77 EDNRA (0.50) ALDH1A1LMNACYP1A2CYP2C19POLB
SCHEMBL29164906 0.76 EDNRA (0.51) ALDH1A1LMNAKCNH2CYP1A2POLB
SCHEMBL19002774 0.74 EDNRA (0.45) ALDH1A1LMNAKCNH2POLBEDNRA
SCHEMBL11469582 0.73 EDNRA (0.56) LMNAKCNH2CYP1A2POLBEDNRA

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-7217723-B2 Substituted benzothiophenes, e.g., 7Z)-7-hydroxyimino-4,5,6,7-tetrahydro-benzo[b]thiophene-3-sulfonic acid [2-(4-fluorophenyl)-2-hydroxyethyl]-methyl-amide; treating allergies such as atopic dermatitis, allergic coryza, bronchial asthma, hypersensitive pneumoniac and pulmonary aspergillosis. EISAI CO., LTD. (JP) 2007-05-15 US disclosed
US-20050227959-A1 Heterocyclic compound having oxime group EISAI CO., LTD. (JP) 2005-10-13 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-20050227959-A1 Heterocyclic compound having oxime group STAT6, HRH4, HRH2 ALDH1A1 1391/4885LMNA 4744/4885KCNH2 1168/4885

“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.