SCHEMBL1300359

SCHEMBL1300359

O=Cc1ccc(OC2CCCCC2)cc1Cl

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.60
TDP1 Q9NUW8 1/20 0.44
HRH3 Q9Y5N1 1/20 0.43
FFAR4 Q5NUL3 4/20 0.42
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
PARP10 Q53GL7 1/20 0.41
MAOB P27338 1/20 0.39
POLB P06746 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
ABL1 P00519 1/20 0.38

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
SCHEMBL25331274 0.98 HPGD (0.57) HPGDTDP1HRH3FFAR4SLC6A2
Hydrochloric Acid SCHEMBL23086663 0.84 HPGD (0.47) HPGDTDP1HRH3SLC6A2SLC6A4
SCHEMBL1134328 0.79 TYR (0.56) HPGDPARP10MAOBPOLBPTGS1
SCHEMBL5863927 0.79 HPGD (0.40) HPGDTDP1
SCHEMBL1299956 0.78 HPGD (0.62) HPGDPARP10MAOB
SCHEMBL23086782 0.76 HRH1 (0.48) FFAR4
SCHEMBL6567753 0.76 PTGS1 (0.48) HPGDFFAR4PARP10POLBPTGS1
SCHEMBL1300309 0.76 HPGD (0.64) HPGD
SCHEMBL27253444 0.76 HPGD (0.47) HPGDHRH3FFAR4SLC6A2SLC6A4
SCHEMBL12107641 0.76 HPGD (1.00) HPGD

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 1/4885TDP1 3235/4885HRH3 2333/4885

“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.