SCHEMBL14508397

SCHEMBL14508397

CCOC(=O)CC1CCc2ccc(S(=O)(=O)Cl)cc21

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 2/20 0.40
HSD17B1 P14061 1/20 0.40
CYP3A4 P08684 1/20 0.39
GAA P10253 1/20 0.39
CYP2C19 P33261 1/20 0.39
MTNR1A P48039 6/20 0.39
NQO2 P16083 5/20 0.39
MTNR1B P49286 5/20 0.39
CYP11B1 P15538 3/20 0.39
CYP11B2 P19099 3/20 0.39
ALDH1A1 P00352 3/20 0.39
POLB P06746 2/20 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
SCHEMBL14508402 0.93 CYP11B1 (0.43) HSD17B1CYP3A4GAACYP2C19MTNR1A
SCHEMBL5481729 0.82 PPARD (0.46) PPARD
SCHEMBL13424132 0.81 MTNR1A (0.55) PPARDHSD17B1MTNR1ANQO2MTNR1B
SCHEMBL1470331 0.79 MTNR1A (0.60) MTNR1ANQO2MTNR1B
SCHEMBL5861977 0.78 NQO2 (0.43) PPARDHSD17B1MTNR1ANQO2MTNR1B
SCHEMBL1472802 0.78 PPARD (0.46) PPARD
SCHEMBL19984873 0.77 CYP11B1 (0.55) PPARDHSD17B1MTNR1ANQO2MTNR1B
SCHEMBL30618514 0.77 CYP1A2 (0.47) PPARDHSD17B1MTNR1AMTNR1BCYP11B1
SCHEMBL3348647 0.77 CYP1A2 (0.47) PPARDHSD17B1MTNR1AMTNR1BCYP11B1
SCHEMBL14508405 0.77 CA1 (0.41) CYP3A4GAACYP2C19ALDH1A1POLB

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-20070117860-A1 Bicyclic indolinesulphonamide derivatives BAYER HEALTHCARE AG (DE) 2007-05-24 US disclosed
US-20070117860-A1 Bicyclic indolinesulphonamide derivatives BAYER HEALTHCARE AG (DE) 2007-05-24 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-20070117860-A1 Bicyclic indolinesulphonamide derivatives PPARD, PPARA, PPARG PPARD 1/4885HSD17B1 287/4885CYP3A4 1593/4885

“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.