SCHEMBL7974285

SCHEMBL7974285

CCS(=O)(=O)c1ccccc1C(=O)NC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.55
CA9 Q16790 5/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
GAA P10253 1/20 0.50
PLK1 P53350 1/20 0.47
JAK2 O60674 1/20 0.47
JAK1 P23458 1/20 0.47
TYK2 P29597 1/20 0.47
PDE4D Q08499 1/20 0.47
MAPT P10636 3/20 0.47
BCAT2 O15382 1/20 0.46
CYP1A2 P05177 2/20 0.46
CYP3A4 P08684 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP2C19 P33261 2/20 0.46
CYP2D6 P10635 1/20 0.46
HPGD P15428 1/20 0.46
ATM Q13315 1/20 0.46
TSHR P16473 1/20 0.45

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
SCHEMBL4805233 0.81 POLB (0.58) POLBCA9CA1CA2GAA
SCHEMBL30843217 0.81 BCAT2 (0.67) POLBCA9CA1CA2GAA
SCHEMBL7984802 0.81 BCAT2 (0.67) POLBCA9CA1CA2GAA
SCHEMBL10435055 0.80 CA2 (0.71) POLBCA9CA1CA2GAA
SCHEMBL31650197 0.80 POLB (0.56) POLBCA9CA1CA2GAA
SCHEMBL11435059 0.80 POLB (0.56) POLBCA9CA1CA2GAA
SCHEMBL16648438 0.79 SMN1; SMN2 (0.49) CA9CA1CA2MAPTBCAT2
SCHEMBL5724579 0.79 TSHR (0.68) CA9CA1CA2MAPTCYP1A2
SCHEMBL24175870 0.79 CA1 (0.67) POLBCA9CA1CA2GAA
SCHEMBL11435058 0.79 POLB (0.55) POLBCA9CA1CA2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-8377923-B2 Triazole derivative or salt thereof ASTELLAS PHARMA INC. (JP) 2013-02-19 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
US-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF ASTELLAS PHARMA INC. (JP) 2011-05-05 US disclosed
EP-2298747-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF Astellas Pharma Inc. (JP) 2011-03-23 EP disclosed
WO-2010001946-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF アステラス製薬株式会社 (JP) 2010-01-07 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-20110105460-A1 TRIAZOLE DERIVATIVE OR SALT THEREOF HSD11B1, HSD11B2, HSD3B1 POLB 2414/4885CA9 1743/4885CA1 835/4885

“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.