SCHEMBL20009387

SCHEMBL20009387

C=C(CCCl)CCCC(C)C

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.33
LMNA P02545 1/20 0.33
KDM1A O60341 1/20 0.30
CA1 P00915 1/20 0.30

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
SCHEMBL28660811 0.88 LMNA (0.41) PTPN1LMNAKDM1ACA1
SCHEMBL9579389 0.84 LMNA (0.35) PTPN1LMNAKDM1ACA1
SCHEMBL8218123 0.79 LMNA (0.35) PTPN1LMNAKDM1ACA1
SCHEMBL11636868 0.79 PTPN1 (0.38) PTPN1LMNAKDM1ACA1
SCHEMBL8218435 0.79 LMNA (0.35) PTPN1LMNAKDM1ACA1
SCHEMBL18458271 0.79 LMNA (0.35) PTPN1LMNAKDM1ACA1
SCHEMBL9191489 0.78 LMNA (0.43) PTPN1LMNACA1
SCHEMBL20009593 0.77 LMNA (0.33) PTPN1LMNAKDM1ACA1
SCHEMBL8215888 0.77 PTPN1 (0.33) PTPN1LMNAKDM1ACA1
SCHEMBL14216732 0.77 PTPN1 (0.37) PTPN1LMNAKDM1ACA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180086784-A1 Phosphonate analogs of HIV inhibitor compounds GILEAD SCIENCES, INC. 2018-03-29 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 (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-20180086784-A1 Phosphonate analogs of HIV inhibitor compounds PIK3CA, TYMP, ITPA PTPN1 1475/4885LMNA 2426/4885KDM1A 3409/4885

“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.