SCHEMBL5985366

SCHEMBL5985366

[CH2]CCCC=CC(CC)CCCCCCCCCCC[CH2]

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
KMT2A Q03164 1/20 0.33
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL5985363 1.00 MEN1 (0.33) MEN1CYP3A4KMT2ATSHRSMN1; SMN2
SCHEMBL5985579 0.96 MEN1 (0.37) MEN1CYP3A4KMT2ATSHRSMN1; SMN2
SCHEMBL5985573 0.96 MEN1 (0.37) MEN1CYP3A4KMT2ATSHRSMN1; SMN2
SCHEMBL5986245 0.92 MEN1 (0.37) MEN1CYP3A4KMT2ATSHRSMN1; SMN2
SCHEMBL5986250 0.92 MEN1 (0.37) MEN1CYP3A4KMT2ATSHRSMN1; SMN2
SCHEMBL5983714 0.92 TSHR (0.32) MEN1CYP3A4KMT2ATSHRSMN1; SMN2
SCHEMBL5983710 0.92 TSHR (0.32) MEN1CYP3A4KMT2ATSHRSMN1; SMN2
SCHEMBL5987145 0.92 TSHR (0.34) MEN1CYP3A4KMT2ATSHRSMN1; SMN2
SCHEMBL5987144 0.92 TSHR (0.34) MEN1CYP3A4KMT2ATSHRSMN1; SMN2
SCHEMBL5984611 0.90 MEN1 (0.34) MEN1CYP3A4KMT2ATSHRSMN1; SMN2

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
US-7018993-B2 Antiandrogenic agent CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2006-03-28 US disclosed
US-20030158164-A1 Novel antiandrogenic agent CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-08-21 US disclosed
EP-1304334-A1 NOVEL ANTIANDROGENIC AGENT CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-04-23 EP disclosed
EP-1219631-A1 ANTIANDROGEN AGENTS CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2002-07-03 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-20030158164-A1 Novel antiandrogenic agent NR5A1, CYP19A1, HSD17B11 MEN1 1082/4885CYP3A4 728/4885KMT2A 2318/4885

“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.