SCHEMBL9928450

SCHEMBL9928450

CCC(C)C(CC)CC1(CC(CC)C(C)CC)c2ccccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3c5c(c6ccc(OC)cc6c3-4)OC(c3ccc(OC)cc3)(c3ccc(N4CCOCC4)cc3)C=C5)cc21

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PRKDC P78527 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
SCHEMBL9898484 0.89 PRKDC (0.31) PRKDC
SCHEMBL16705199 0.89 PRKDC (0.33) PRKDC
SCHEMBL9928456 0.89
SCHEMBL18102198 0.87 PRKDC (0.36) PRKDC
SCHEMBL25607195 0.85 PRKDC (0.36) PRKDC
SCHEMBL9928399 0.84 ALDH1A1 (0.37) PRKDC
SCHEMBL9926880 0.84 PRKDC (0.36) PRKDC
SCHEMBL25607198 0.84 ALDH1A1 (0.35) PRKDC
SCHEMBL25844763 0.83 ALDH1A1 (0.35) PRKDC
SCHEMBL9928447 0.83 AKT1 (0.33) PRKDC

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-20120145973-A1 Photochromic Materials That Include Indeno-Fused Naphthopyrans TRANSITIONS OPTICAL INC. (US) 2012-06-14 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-20120145973-A1 Photochromic Materials That Include Indeno-Fused Naphthopyrans NQO1, INTS6, IPO4 PRKDC 4513/4885

“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.