SCHEMBL1300071

SCHEMBL1300071

Cc1cc(C=O)ccc1OCC(C)C1CCCCC1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.42
ALDH1A3 P47895 2/20 0.39
LMNA P02545 3/20 0.38
FDPS P14324 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 4/20 0.37
KDM4E B2RXH2 2/20 0.37
POLB P06746 1/20 0.37
TSHR P16473 1/20 0.36
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35

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
SCHEMBL1300110 0.86 FDPS (0.56) HPGDLMNAFDPSSMN1; SMN2ALDH1A1
SCHEMBL1300339 0.85 HPGD (0.41) HPGDALDH1A3LMNAFDPSSMN1; SMN2
SCHEMBL1299414 0.80 HPGD (0.71) HPGD
SCHEMBL1299416 0.80 HPGD (0.71) HPGD
SCHEMBL5448983 0.79 FDPS (0.46) HPGDALDH1A3LMNAFDPSSMN1; SMN2
SCHEMBL4177854 0.79 HPGD (0.63) HPGDALDH1A3FDPSALDH1A1
SCHEMBL5451218 0.75 HPGD (0.59) HPGDALDH1A3FDPSALDH1A1TSHR
SCHEMBL3721435 0.74 ALDH1A1 (0.62) HPGDLMNAFDPSALDH1A1KDM4E
SCHEMBL16272283 0.74 ALDH1A3 (0.45) HPGDALDH1A3ALDH1A1POLBTSHR
SCHEMBL5451545 0.74 HPGD (0.54) HPGDALDH1A3FDPSALDH1A1TSHR

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
EP-2383263-B1 NOVEL THIAZOLIDINEDIONE DERIVATIVE AND USE THEREOF UNIV CHOSUN IACF (KR) 2014-04-16 EP disclosed
US-8637558-B2 Thiazolidinedione derivative and use thereof INDUSTRY-ACADEMIC COOPERATION FOUNDATION, CHOSUN UNIVERSITY (KR) 2014-01-28 US disclosed
US-20110269954-A1 NOVEL THIAZOLIDINEDIONE DERIVATIVE AND USE THEREOF INDUSTRY-ACADEMIC COOPERATION FOUNDATION, CHOSUN UNIVERSITY (KR) 2011-11-03 US disclosed
EP-2383263-A2 NOVEL THIAZOLIDINEDIONE DERIVATIVE AND USE THEREOF Industry-academic Cooperation Foundation, Chosun University (KR) 2011-11-02 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-20110269954-A1 NOVEL THIAZOLIDINEDIONE DERIVATIVE AND USE THEREOF HPGD, CYP27B1, GCDH HPGD 1/4885ALDH1A3 107/4885LMNA 3636/4885

“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.