SCHEMBL6357879

SCHEMBL6357879

[O-][n+]1ccccc1CCO

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
LMNA P02545 4/20 0.40
HTT P42858 1/20 0.40
TDP1 Q9NUW8 2/20 0.39
KDM4E B2RXH2 2/20 0.39
SLC2A1 P11166 1/20 0.35
MAPT P10636 2/20 0.33
RAB9A P51151 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
GAA P10253 2/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
NPC1 O15118 2/20 0.32
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
HSD17B10 Q99714 1/20 0.31
KMT2A Q03164 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
F10 P00742 5/20 0.30

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
SCHEMBL30473425 0.82
SCHEMBL14732897 0.82 ALDH1A1 (0.48) ALDH1A1LMNAHTTTDP1KDM4E
SCHEMBL904673 0.82
Methane SCHEMBL8177743 0.80 ALDH1A1 (0.47) ALDH1A1LMNAHTTTDP1KDM4E
SCHEMBL904409 0.78 ALDH1A1 (0.46) ALDH1A1LMNAHTTTDP1KDM4E
SCHEMBL2552339 0.78 ALDH1A1 (0.46) ALDH1A1LMNAHTTTDP1KDM4E
SCHEMBL2952828 0.76 SLC2A1 (0.53) ALDH1A1LMNAHTTTDP1KDM4E
SCHEMBL5234381 0.75 KCNH2 (0.46) ALDH1A1LMNAHTTTDP1KDM4E
SCHEMBL904632 0.75
SCHEMBL9602287 0.74 HSD17B10 (0.47) ALDH1A1TDP1KDM4EMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8445685-B2 Process to prepare pioglitazone via several novel intermediates CADILA HEALTHCARE LIMITED (IN) 2013-05-21 US disclosed
US-8173816-B2 Process to prepare pioglitazone via several novel intermediates CADILA HEALTHCARE LIMITED (IN) 2012-05-08 US disclosed
US-20120077848-A1 NOVEL PROCESS TO PREPARE PIOGLITAZONE VIA SEVERAL NOVEL INTERMEDIATES CADILA HEALTHCARE LIMITED (IN) 2012-03-29 US disclosed
US-20110021576-A1 NOVEL PROCESS TO PREPARE PIOGLITAZONE VIA SEVERAL NOVEL INTERMEDIATES CADILA HEALTHCARE LIMITED (IN) 2011-01-27 US disclosed
US-7863300-B2 Process to prepare pioglitazone via several novel intermediates CADILA HEALTHCARE LIMITED (IN) 2011-01-04 US disclosed
US-7671207-B2 Process to prepare pioglitazone via several novel intermediates CADILA HEALTHCARE LIMITED (IN) 2010-03-02 US disclosed
US-7465801-B2 Process to prepare pioglitazone via several novel intermediates CADILA HEALTHCARE LIMITED (IN) 2008-12-16 US disclosed
US-20080300282-A1 Novel process to prepare pioglitazone via several novel intermediates CADILA HEALTHCARE LIMITED (IN) 2008-12-04 US disclosed
US-20080004446-A1 Novel process to prepare pioglitazone via several novel intermediates CADILA HEALTHCARE LIMITED (IN) 2008-01-03 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 (4 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-20080004446-A1 Novel process to prepare pioglitazone via several novel intermediates PPARD, PPARG, PPARA ALDH1A1 742/4885LMNA 2841/4885HTT 2193/4885
US-20080300282-A1 Novel process to prepare pioglitazone via several novel intermediates PPARD, PPARG, PPARA ALDH1A1 1084/4885LMNA 2601/4885HTT 2409/4885
US-20120077848-A1 NOVEL PROCESS TO PREPARE PIOGLITAZONE VIA SEVERAL NOVEL INTERMEDIATES PPARD, PPARG, PPARA ALDH1A1 1084/4885LMNA 2601/4885HTT 2409/4885
US-20110021576-A1 NOVEL PROCESS TO PREPARE PIOGLITAZONE VIA SEVERAL NOVEL INTERMEDIATES PPARD, PPARG, PPARA ALDH1A1 1084/4885LMNA 2601/4885HTT 2409/4885

“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.