SCHEMBL15030822

SCHEMBL15030822

CC1(C)c2ccccc2C2(c3cc(-c4ccccc4-c4ccccc4)ccc3N(c3ccccc3)c3ccc(-c4ccccc4-c4ccccc4)cc32)c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PGR P06401 9/20 0.41
RARB P10826 1/20 0.36
RARG P13631 1/20 0.36
RXRA P19793 1/20 0.36
ALDH1A1 P00352 1/20 0.34
PDK2 Q15119 1/20 0.32
GRM5 P41594 1/20 0.32
ADAMTS5 Q9UNA0 1/20 0.32
AR P10275 1/20 0.31
PTGS2 P35354 1/20 0.31
PDE6D O43924 1/20 0.31
ABCG2 Q9UNQ0 1/20 0.31
MGLL Q99685 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
SCHEMBL15030838 0.89 PGR (0.33) PGRRARBRARGRXRAALDH1A1
SCHEMBL15030716 0.84 GRM5 (0.33) PGRRARBRARGRXRAPDK2
SCHEMBL10038900 0.84 PDK2 (0.42) PGRALDH1A1PDK2
SCHEMBL17197532 0.82 PDK2 (0.40) PGRPDK2ARPDE6D
SCHEMBL17197576 0.82 PDK2 (0.40) PGRPDK2PDE6D
SCHEMBL17197585 0.81 PDE6D (0.39) PGRPDK2ARPDE6D
SCHEMBL15290070 0.81 PDK2 (0.42) PGRPDK2PDE6DMGLL
SCHEMBL808313 0.81 PGR (0.40) PGRALDH1A1PDK2
SCHEMBL15183557 0.81 PDK2 (0.42) PGRPDK2PDE6DMGLL
SCHEMBL21868624 0.81 ALDH1A1 (0.35) RARBRARGRXRAALDH1A1PDK2

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
US-10396297-B2 Materials for electronic devices MERCK PATENT GMBH (DE) 2019-08-27 US disclosed
US-10305040-B2 Spiro dihydroacridine derivatives and the use thereof as materials for organic electroluminescence devices MERCK PATENT GMBH (DE) 2019-05-28 US disclosed
US-20170331053-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-11-16 US disclosed
US-20170331053-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-11-16 US disclosed
EP-2780325-B1 SPIRO-DIHYDROACRIDINE DERIVATIVES AND THEIR USE AS MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2016-02-03 EP disclosed
US-20140316134-A1 SPIRO DIHYDROACRIDINE DERIVATIVES AND THE USE THEREOF AS MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2014-10-23 US disclosed
US-20140316134-A1 SPIRO DIHYDROACRIDINE DERIVATIVES AND THE USE THEREOF AS MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2014-10-23 US disclosed
WO-2013083216-A1 SPIRO DIHYDROACRIDINE DERIVATIVES AND THE USE THEREOF AS MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2013-06-13 WO 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 (3 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-10305040-B2 Spiro dihydroacridine derivatives and the use thereof as materials for organic electroluminescence devices SORD, ALDH1A1, SDHA PGR 2481/4885RARB 2447/4885RARG 2432/4885
US-10396297-B2 Materials for electronic devices DDT, PNMT, COMT PGR 1715/4885RARB 3127/4885RARG 3221/4885
US-20170331053-A1 MATERIALS FOR ELECTRONIC DEVICES DDT, PNMT, COMT PGR 1715/4885RARB 3127/4885RARG 3221/4885

“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.