SCHEMBL12229258

SCHEMBL12229258

C=C(C)c1ccc2c(Br)c3cc(C(C)(C)C)ccc3c(-c3cccc4c3oc3ccccc34)c2c1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.36
GGPS1 O95749 1/20 0.32
IDO1 P14902 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
PRKDC P78527 4/20 0.31
AVPR1A P37288 1/20 0.31
ATM Q13315 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
SCHEMBL12229902 0.94 ALOX5 (0.40) ALOX5GGPS1HDAC8PRKDCAVPR1A
SCHEMBL2257243 0.90 ALOX5 (0.40) ALOX5GGPS1HDAC8PRKDCATM
SCHEMBL12229293 0.88 ALOX5 (0.35) ALOX5GGPS1
SCHEMBL13860947 0.85 ALOX5 (0.47) ALOX5GGPS1IDO1HDAC8PRKDC
SCHEMBL12229294 0.85 ALOX5 (0.38) ALOX5GGPS1PRKDC
SCHEMBL12229297 0.85 ALOX5 (0.36) ALOX5GGPS1
SCHEMBL9890829 0.83 ALOX5 (0.46) ALOX5GGPS1HDAC8PRKDCATM
SCHEMBL2250911 0.83 ALOX5 (0.46) ALOX5GGPS1HDAC8PRKDCATM
SCHEMBL29306842 0.81 ALOX5 (0.44) ALOX5GGPS1HDAC8PRKDCATM
SCHEMBL12377417 0.79 ALOX5 (0.41) ALOX5GGPS1HDAC8PRKDCAVPR1A

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-20110248217-A1 ELECTROLUMINESCENT DEVICE UDC IRELAND LIMITED (IE) 2011-10-13 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-20110248217-A1 ELECTROLUMINESCENT DEVICE DDT, CD99, EED ALOX5 741/4885GGPS1 2096/4885IDO1 2352/4885

“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.