SCHEMBL7166847

SCHEMBL7166847

CCc1cc(C(=O)OC)ccc1NS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2C9 P11712 7/20 0.70
▸ TCF4 P15884 1/20 0.60
▸ CTNNB1 P35222 1/20 0.60
▸ ALDH1A1 P00352 7/20 0.58
▸ LMNA P02545 3/20 0.58
▸ KDM4E B2RXH2 2/20 0.58
▸ TSHR P16473 3/20 0.57
▸ NPSR1 Q6W5P4 1/20 0.57
▸ FFAR4 Q5NUL3 1/20 0.53
▸ MAPT P10636 1/20 0.53
▸ GAA P10253 1/20 0.51
▸ KMT2A Q03164 1/20 0.51
▸ HPGD P15428 1/20 0.51
▸ CASP1 P29466 1/20 0.51
▸ CASP7 P55210 1/20 0.51
▸ HSD17B10 Q99714 1/20 0.51
▸ CYP1A2 P05177 1/20 0.50
▸ POLB P06746 1/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ CYP2D6 P10635 1/20 0.50

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
SCHEMBL7573928 0.87 CYP2C9 (0.82) CYP2C9TCF4CTNNB1ALDH1A1LMNA
SCHEMBL28560173 0.85 CYP2C9 (0.80) CYP2C9TCF4CTNNB1ALDH1A1LMNA
SCHEMBL1073233 0.83 CYP2C9 (1.00) CYP2C9TCF4CTNNB1ALDH1A1LMNA
SCHEMBL3511736 0.82 CYP2C9 (0.64) CYP2C9TCF4CTNNB1ALDH1A1LMNA
SCHEMBL24102911 0.81 CYP2C9 (0.76) CYP2C9TCF4CTNNB1ALDH1A1LMNA
SCHEMBL22391857 0.81 CYP2C9 (0.76) CYP2C9TCF4CTNNB1ALDH1A1LMNA
SCHEMBL29535237 0.81 CYP2C9 (0.76) CYP2C9TCF4CTNNB1ALDH1A1LMNA
SCHEMBL16119560 0.81 CYP2C9 (0.76) CYP2C9TCF4CTNNB1ALDH1A1LMNA
SCHEMBL28702608 0.80 CYP2C9 (0.67) CYP2C9TCF4CTNNB1ALDH1A1LMNA
SCHEMBL24102929 0.80 CYP2C9 (0.79) CYP2C9TCF4CTNNB1ALDH1A1LMNA

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-20030171376-A1 Antiarthritic agents CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-09-11 — — US disclosed
US-6559149-B1 Lesser side effects without compromise in their efficacy CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-05-06 — — US disclosed
EP-0632038-B1 METHOTREXATE DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2001-08-22 — — EP disclosed
EP-0632038-A1 METHOTREXATE DERIVATIVE Chugai Seiyaku Kabushiki Kaisha (JP) 1995-01-04 — — EP 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-20030171376-A1 Antiarthritic agents BCOR, RCOR1, IL4 CYP2C9 2757/4885TCF4 780/4885CTNNB1 3623/4885

“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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