SCHEMBL9920831

SCHEMBL9920831

CC(C)(C)c1ccc(-c2ccc3ccc4c(-c5cccc6c5oc5ccccc56)ccc5ccc2c3c54)cc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.43
PRKDC P78527 4/20 0.35
PIK3CD O00329 1/20 0.35
PIK3CB P42338 1/20 0.35
GPR84 Q9NQS5 1/20 0.35
GGPS1 O95749 1/20 0.35
S1PR1 P21453 1/20 0.34
CDC14B O60729 3/20 0.33
CDC14A Q9UNH5 3/20 0.33
PTGES2 Q9H7Z7 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
CYP2C19 P33261 1/20 0.32
CDC25A P30304 1/20 0.32
CDC25B P30305 1/20 0.32
CDC25C P30307 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 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
SCHEMBL9920861 0.96 ALOX5 (0.46) ALOX5PRKDCPIK3CDPIK3CBGPR84
SCHEMBL12380172 0.96 ALOX5 (0.46) ALOX5PRKDCPIK3CDPIK3CBGPR84
SCHEMBL12380234 0.95 ALOX5 (0.45) ALOX5PRKDCPIK3CDPIK3CBGPR84
SCHEMBL12380123 0.93 ALOX5 (0.43) ALOX5PRKDCPIK3CDPIK3CBGPR84
SCHEMBL9920767 0.93 ALOX5 (0.43) ALOX5PRKDCPIK3CDPIK3CBGPR84
SCHEMBL9920908 0.93 ALOX5 (0.43) ALOX5PRKDCPIK3CDPIK3CBGPR84
SCHEMBL12380243 0.92 ALOX5 (0.45) ALOX5PRKDCPIK3CDPIK3CBGPR84
SCHEMBL9920904 0.92 ALOX5 (0.48) ALOX5PRKDCPIK3CDPIK3CBGPR84
SCHEMBL12380155 0.92 ALOX5 (0.48) ALOX5PRKDCPIK3CDPIK3CBGPR84
SCHEMBL9920784 0.91 ALOX5 (0.47) ALOX5PRKDCGPR84GGPS1S1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2463352-B1 Light emitting device material and light emitting device TORAY INDUSTRIES (JP) 2018-05-02 EP disclosed
EP-1942171-B1 LIGHT-EMITTING DEVICE MATERIAL AND LIGHT-EMITTING DEVICE TORAY INDUSTRIES (JP) 2018-04-18 EP disclosed
US-20140061629-A1 LIGHT-EMITTING DEVICE MATERIAL AND LIGHT-EMITTING DEVICE TORAY INDUSTRIES, INC. (JP) 2014-03-06 US disclosed
US-20140061629-A1 LIGHT-EMITTING DEVICE MATERIAL AND LIGHT-EMITTING DEVICE TORAY INDUSTRIES, INC. (JP) 2014-03-06 US disclosed
EP-2463351-A2 Light emitting device material and light emitting device Toray Industries, Inc. (JP) 2012-06-13 EP disclosed
EP-2463352-A2 Light emitting device material and light emitting device Toray Industries, Inc. (JP) 2012-06-13 EP disclosed
US-20090096356-A1 Light-emitting device material and light-emitting device TORAY INDUSTRIES, INC. (JP) 2009-04-16 US disclosed
EP-1942171-A1 LIGHT-EMITTING DEVICE MATERIAL AND LIGHT-EMITTING DEVICE TORAY INDUSTRIES, INC. (JP) 2008-07-09 EP 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-20090096356-A1 Light-emitting device material and light-emitting device PRMT9, CCNL2, MRPL9 ALOX5 1517/4885PRKDC 4330/4885PIK3CD 4570/4885

“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.