SCHEMBL12263261

SCHEMBL12263261

Cn1cncc(-c2ccc(C(=O)O)cc2)c1=O

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.44
CHEK1 O14757 4/20 0.43
ADH5 P11766 4/20 0.43
MKNK1 Q9BUB5 1/20 0.42
MKNK2 Q9HBH9 1/20 0.42
ADORA2A P29274 1/20 0.41
ADORA2B P29275 1/20 0.41
ADORA1 P30542 1/20 0.41
MAP4K4 O95819 3/20 0.40
AR P10275 1/20 0.39
IDO1 P14902 1/20 0.39

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
SCHEMBL12263260 0.83 ALDH1A1 (0.48) HPGDADORA2AADORA2B
SCHEMBL5344758 0.80 HPGDS (0.53) CHEK1ADH5MKNK1MKNK2IDO1
SCHEMBL12263446 0.80 P2RX3 (0.43) HPGDCHEK1ADH5MKNK1MKNK2
SCHEMBL7821311 0.76 ADH5 (0.54) ADH5MAP4K4IDO1
SCHEMBL12263289 0.75 HPGD (0.46) HPGD
SCHEMBL31735528 0.72 HPGD (0.46) HPGDCHEK1ADH5ADORA2AADORA2B
SCHEMBL30948515 0.72 FNTB (0.45)
SCHEMBL24268069 0.71 SYK (0.45)
SCHEMBL28758928 0.70 TBXAS1 (0.50)
SCHEMBL25099090 0.69 CYP11B2 (0.55) HPGDCHEK1ADH5MKNK1MKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8022208-B2 Benzene derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2011-09-20 US disclosed
US-8022208-B2 Benzene derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2011-09-20 US disclosed
US-20090054352-A1 BENZENE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2009-02-26 US disclosed
US-20090054352-A1 BENZENE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2009-02-26 US disclosed
EP-1947086-A1 BENZENE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2008-07-23 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-20090054352-A1 BENZENE DERIVATIVE OR SALT THEREOF F12, F2, SERPINC1 HPGD 582/4885CHEK1 3532/4885ADH5 1552/4885

“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.