SCHEMBL1299701

SCHEMBL1299701

CC1(COc2ccc(C=O)cc2)CCCCC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.63
PARP1 P09874 1/20 0.63
ALDH1A1 P00352 7/20 0.49
MAPT P10636 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
TP53 P04637 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
ALOX15 P16050 1/20 0.49
TSHR P16473 1/20 0.49
HSD17B10 Q99714 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
SMN1; SMN2 Q16637 3/20 0.44
LMNA P02545 2/20 0.44
CYP2A6 P11509 1/20 0.43
PPARG P37231 1/20 0.40
ALDH1A3 P47895 1/20 0.40
KDM4E B2RXH2 2/20 0.39
RAB9A P51151 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
SCHEMBL16838854 0.92 HPGD (0.52) HPGDPARP1ALDH1A1MAPTMEN1
SCHEMBL30903804 0.84 HPGD (0.47) HPGDPARP1ALDH1A1MAPTMEN1
SCHEMBL13881641 0.82 MAOA (0.49) HPGDPARP1ALDH1A1MAPTMEN1
SCHEMBL2173787 0.82 MAOA (0.49) HPGDPARP1ALDH1A1MAPTMEN1
SCHEMBL10329385 0.81 ACACB (0.45) HPGDPARP1ALDH1A1MAPTMEN1
SCHEMBL9440408 0.80 HPGD (0.54) HPGDPARP1ALDH1A1MAPTMEN1
SCHEMBL227163 0.79 ALDH1A1 (0.43) HPGDPARP1ALDH1A1MAPTMEN1
SCHEMBL8503886 0.78 HPGD (0.52) HPGDPARP1ALDH1A1MAPTMEN1
SCHEMBL1299780 0.78 HPGD (1.00) HPGDPARP1RAB9A
SCHEMBL1299778 0.78 HPGD (1.00) HPGDPARP1RAB9A

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
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
US-7973062-B2 Androgen receptor-ablative agents THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2011-07-05 US disclosed
US-20090291992-A1 ANDROGEN RECEPTOR-ABLATIVE AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2009-11-26 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 (2 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-20090291992-A1 ANDROGEN RECEPTOR-ABLATIVE AGENTS AR, ESRRB, KLK3 HPGD 183/4885PARP1 1402/4885ALDH1A1 96/4885
US-20110269954-A1 NOVEL THIAZOLIDINEDIONE DERIVATIVE AND USE THEREOF HPGD, CYP27B1, GCDH HPGD 1/4885PARP1 3763/4885ALDH1A1 57/4885

“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.