SCHEMBL741127

SCHEMBL741127

CCOc1ccc(C(C)C)cc1S(=O)(=O)Cl

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.59
▸ SMN1; SMN2 Q16637 3/20 0.59
▸ TSHR P16473 6/20 0.57
▸ KMT2A Q03164 3/20 0.57
▸ ALPL P05186 1/20 0.54
▸ TRPV4 Q9HBA0 1/20 0.48
▸ MEN1 O00255 2/20 0.47
▸ HPGD P15428 1/20 0.41
▸ BCHE P06276 2/20 0.40
▸ ACHE P22303 2/20 0.40
▸ POLB P06746 2/20 0.40

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
SCHEMBL24313767 0.89 TSHR (0.50) ALDH1A1SMN1; SMN2TSHRKMT2AALPL
SCHEMBL29469893 0.84 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2TSHRKMT2AALPL
SCHEMBL31371876 0.84 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2TSHRKMT2AALPL
SCHEMBL24314301 0.82 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2TSHRKMT2AALPL
SCHEMBL10641518 0.82 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2TSHRTRPV4HPGD
SCHEMBL24313728 0.81 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2TSHRKMT2AALPL
SCHEMBL24313621 0.81 GLRA1 (0.44) ALDH1A1SMN1; SMN2TSHRKMT2AALPL
SCHEMBL29469921 0.81 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2TSHRKMT2AALPL
SCHEMBL2703971 0.79 TSHR (0.62) ALDH1A1SMN1; SMN2TSHRKMT2AALPL
SCHEMBL34468880 0.79 TSHR (0.58) ALDH1A1SMN1; SMN2TSHRKMT2AALPL

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-8138333-B2 Sulfonyl-indole derivatives PROXIMAGEN LIMITED (GB) 2012-03-20 — — US disclosed
EP-2134714-A1 TRICYCLIC ISOQUINOLINE DERIVATIVES FOR TREATMENT OF OBESITY Biovitrum AB (publ) (SE) 2009-12-23 — — EP disclosed
US-20080293694-A1 New compounds BIOVITRUM AB (PUBL.) (SE) 2008-11-27 — — US disclosed
WO-2008110598-A1 TRICYCLIC ISOQUINOLINE DERIVATIVES FOR TREATMENT OF OBESITY BIOVITRUM AB (PUBL) (SE) 2008-09-18 — — WO 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-20080293694-A1 New compounds HTR6, HTR1A, HTR1B ALDH1A1 901/4885SMN1; SMN2 1945/4885TSHR 270/4885

“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.

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