SCHEMBL2174763

SCHEMBL2174763

CC(Oc1cccc(C=C2SC(=O)NC2=O)c1)C1CCCCC1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 7/20 0.63
PIM2 Q9P1W9 7/20 0.63
AKR1B1 P15121 4/20 0.63
HPGD P15428 4/20 0.60
ADAMTS5 Q9UNA0 3/20 0.55
CISD1 Q9NZ45 2/20 0.51
MAOA P21397 1/20 0.51
MAOB P27338 1/20 0.51
GSK3B P49841 1/20 0.51

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
SCHEMBL2785238 1.00 PIM1 (0.63) PIM1PIM2AKR1B1HPGDADAMTS5
SCHEMBL5800236 0.88 HPGD (0.64) PIM1PIM2AKR1B1HPGD
SCHEMBL3291603 0.88 HPGD (0.64) PIM1PIM2AKR1B1HPGD
SCHEMBL2546852 0.82 PIM1 (0.70) PIM1PIM2AKR1B1ADAMTS5CISD1
SCHEMBL2546853 0.82 PIM1 (0.70) PIM1PIM2AKR1B1ADAMTS5CISD1
SCHEMBL2174556 0.81 PDE4B (0.68) PIM1PIM2HPGDGSK3B
SCHEMBL2172862 0.81 HPGD (0.68) HPGD
SCHEMBL2786377 0.81 HPGD (0.68) HPGD
SCHEMBL2173332 0.80 HPGD (0.56) PIM1PIM2HPGD
SCHEMBL2785066 0.80 HPGD (0.56) PIM1PIM2HPGD

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
US-20090291992-A1 ANDROGEN RECEPTOR-ABLATIVE AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2009-11-26 US claimed
EP-2254576-B1 ANDROGEN RECEPTOR-ABLATIVE AGENTS UNIV OHIO STATE RES FOUND (US) 2013-08-28 EP disclosed
US-7973062-B2 Androgen receptor-ablative agents THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2011-07-05 US disclosed
EP-2254576-A1 ANDROGEN RECEPTOT-ABLATIVE AGENTS The Ohio State University Research Foundation (US) 2010-12-01 EP disclosed
US-20090291992-A1 ANDROGEN RECEPTOR-ABLATIVE AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2009-11-26 US disclosed
WO-2009105621-A1 ANDROGEN RECEPTOT-ABLATIVE AGENTS THE OHIO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2009-08-27 WO 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-20090291992-A1 ANDROGEN RECEPTOR-ABLATIVE AGENTS AR, ESRRB, KLK3 PIM1 4023/4885PIM2 3662/4885AKR1B1 36/4885

“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.