SCHEMBL1300375

SCHEMBL1300375

CC1CCC(COc2ccc(C=C3SC(=O)NC3=O)cc2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HPGD P15428 15/20 1.00
PIM1 P11309 3/20 0.64
PIM2 Q9P1W9 3/20 0.64
AKR1B1 P15121 1/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
MAOA P21397 1/20 0.56
MAOB P27338 1/20 0.56

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
SCHEMBL6866296 1.00 HPGD (1.00) HPGDPIM1PIM2AKR1B1NPC1
SCHEMBL1300371 1.00 HPGD (1.00) HPGDPIM1PIM2AKR1B1NPC1
SCHEMBL934038 0.88 HPGD (1.00) HPGDPIM1PIM2
SCHEMBL12107393 0.88 HPGD (1.00) HPGDPIM1PIM2
SCHEMBL934036 0.88 HPGD (1.00) HPGDPIM1PIM2
SCHEMBL1299267 0.87 HPGD (1.00) HPGD
SCHEMBL1299268 0.87 HPGD (1.00) HPGD
SCHEMBL12107703 0.84 HPGD (1.00) HPGDPIM1PIM2MAOAMAOB
SCHEMBL1299725 0.84 HPGD (0.80) HPGDPIM1PIM2MAOAMAOB
SCHEMBL1299729 0.84 HPGD (0.80) HPGDPIM1PIM2MAOAMAOB

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 1/4885PIM1 4115/4885PIM2 4136/4885

“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.