SCHEMBL12229902

SCHEMBL12229902

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

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.40
GGPS1 O95749 1/20 0.35
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
HPGD P15428 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
PRKDC P78527 2/20 0.32
ALDH1A1 P00352 1/20 0.32
DYRK1A Q13627 1/20 0.32
AVPR1A P37288 1/20 0.31
PTGES2 Q9H7Z7 1/20 0.31
KIF11 P52732 2/20 0.31
AHR P35869 1/20 0.31

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
SCHEMBL12229258 0.94 ALOX5 (0.36) ALOX5GGPS1HDAC8PRKDCAVPR1A
SCHEMBL12229293 0.93 ALOX5 (0.35) ALOX5GGPS1
SCHEMBL13860947 0.91 ALOX5 (0.47) ALOX5GGPS1NPC1RAB9AMEN1
SCHEMBL12229294 0.91 ALOX5 (0.38) ALOX5GGPS1MAPTPRKDCALDH1A1
SCHEMBL12229297 0.91 ALOX5 (0.36) ALOX5GGPS1
SCHEMBL9890829 0.89 ALOX5 (0.46) ALOX5GGPS1NPC1RAB9AMAPT
SCHEMBL2250911 0.89 ALOX5 (0.46) ALOX5GGPS1NPC1RAB9AMAPT
SCHEMBL29306842 0.86 ALOX5 (0.44) ALOX5GGPS1NPC1RAB9AMAPT
SCHEMBL12377417 0.83 ALOX5 (0.41) ALOX5GGPS1NPC1RAB9AMAPT
SCHEMBL9890834 0.83 ALOX5 (0.43) ALOX5GGPS1NPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110248217-A1 ELECTROLUMINESCENT DEVICE UDC IRELAND LIMITED (IE) 2011-10-13 US disclosed
US-7989644-B2 Electroluminescent device BASF SE (DE) 2011-08-02 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 2096/4885NPC1 4590/4885

“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.