SCHEMBL4524340

SCHEMBL4524340

C=CCOc1c(C)c(C)c2c(c1C)CCC(C)(COc1ccc(/C=C3/SC(=O)NC3=O)cc1)O2

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.49
PARP1 P09874 1/20 0.49
MEN1 O00255 1/20 0.47
MAPT P10636 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
PIM1 P11309 3/20 0.45
PIM2 Q9P1W9 3/20 0.45
CISD1 Q9NZ45 1/20 0.41
MAOA P21397 2/20 0.41
MAOB P27338 2/20 0.41
PTGS2 P35354 1/20 0.41
GPR35 Q9HC97 1/20 0.41
AKR1B1 P15121 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
PTPN1 P18031 1/20 0.40
POLB P06746 1/20 0.40
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL13256847 1.00 HPGD (0.49) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL4524343 1.00 HPGD (0.49) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL13256902 0.94 HDAC4 (0.46) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL13256848 0.93 PDE4B (0.47) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL13256877 0.92 PIM1 (0.46) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL4524348 0.92 MEN1 (0.46) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL13256790 0.90 PTPN1 (0.38) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL13256854 0.90 MEN1 (0.48) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL13256859 0.89 HPGD (0.46) HPGDPARP1MEN1MAPTKMT2A
SCHEMBL7836423 0.89 HPGD (0.56) HPGDPARP1MEN1MAPTKMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7566787-B2 Small molecule cyclin D1 ablative agents THE OHIO STATE UNIVERSITY (US) 2009-07-28 US disclosed
US-20060252802-A1 Small molecule cyclin D1 ablative agents NIH - DEITR 2006-11-09 US disclosed
WO-2006069217-A2 SMALL MOLECULE CYCLIN D1 ABLATIVE AGENTS THE OHIO STATE RESEARCH FOUNDATION (US) 2006-06-29 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-20060252802-A1 Small molecule cyclin D1 ablative agents CDK4, CCNK, CCNA1 HPGD 597/4885PARP1 390/4885MEN1 3068/4885

“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.