SCHEMBL4320311

SCHEMBL4320311

OC12CC3CC(O)(C1)C(F)C(O)(C3)C2

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PKM P14618 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
SCHEMBL6760912 0.75 PKM (0.32) PKM
SCHEMBL424435 0.74 PKM (0.42) PKM
SCHEMBL18171377 0.71
SCHEMBL4333948 0.70 PKM (0.36) PKM
SCHEMBL23096814 0.67 PKM (0.37) PKM
SCHEMBL16181727 0.67 PKM (0.37) PKM
SCHEMBL11365017 0.67 PKM (0.33) PKM
SCHEMBL21789023 0.66
SCHEMBL3843526 0.65 PKM (0.36) PKM
SCHEMBL986904 0.62 PKM (0.33) PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7511177-B2 Fluoroadamantane derivative ASAHI GLASS COMPANY, LIMITED (JP) 2009-03-31 US disclosed
US-7488847-B2 Fluorinated adamantane and its derivatives ASAHI GLASS COMPANY, LIMITED (JP) 2009-02-10 US disclosed
US-7402714-B2 Fluoroadamantane derivative ASAHI GLASS COMPANY, LIMITED (JP) 2008-07-22 US disclosed
US-20080132736-A1 FLUOROADAMANTANE DERIVATIVE ASAHI GLASS COMPANY, LIMITED (JP) 2008-06-05 US disclosed
US-20070129566-A1 FLUOROADAMANTANE DERIVATIVE ASAHI GLASS COMPANY, LIMITED (JP) 2007-06-07 US disclosed
EP-1757575-A1 FLUOROADAMANTANE DERIVATIVE Asahi Glass Company, Limited (JP) 2007-02-28 EP disclosed
US-20050288528-A1 Fluorinated adamantane and its derivatives ASAHI GLASS COMPANY LIMITED (JP) 2005-12-29 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 (3 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-20050288528-A1 Fluorinated adamantane and its derivatives ADH1A, AFF1, ADH5 PKM 4795/4885
US-20080132736-A1 FLUOROADAMANTANE DERIVATIVE AFF1, AFF2, AFF4 PKM 3859/4885
US-20070129566-A1 FLUOROADAMANTANE DERIVATIVE AFF1, AFF2, AFF4 PKM 3859/4885

“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.