SCHEMBL21037803

SCHEMBL21037803

CC1(C)c2cc(-c3cccc4c3oc3ccccc34)ccc2-c2c(Cl)cccc21

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.49
PRKDC P78527 3/20 0.40
GGPS1 O95749 1/20 0.38
AHR P35869 4/20 0.37
PTGES2 Q9H7Z7 1/20 0.36
PDK2 Q15119 2/20 0.35
PGR P06401 3/20 0.35
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
MEN1 O00255 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 1/20 0.33
PIK3CD O00329 1/20 0.32
PIK3CB P42338 1/20 0.32
PIM1 P11309 1/20 0.32
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
PIM3 Q86V86 1/20 0.32
PIM2 Q9P1W9 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
SCHEMBL24279359 0.88 ALOX5 (0.48) ALOX5PRKDCGGPS1AHRPTGES2
SCHEMBL21742671 0.87 ALOX5 (0.50) ALOX5PRKDCGGPS1PTGES2PDK2
SCHEMBL12324541 0.87 ALOX5 (0.57) ALOX5PRKDCGGPS1AHRPTGES2
SCHEMBL20276869 0.87 ALOX5 (0.59) ALOX5PRKDCGGPS1AHRPTGES2
SCHEMBL21742727 0.86 ALOX5 (0.49) ALOX5PRKDCGGPS1PTGES2PDK2
SCHEMBL16017825 0.86 ALOX5 (0.56) ALOX5PRKDCGGPS1AHRPTGES2
SCHEMBL24988192 0.84 ALOX5 (0.42) ALOX5PRKDCGGPS1AHRPTGES2
SCHEMBL18086150 0.83 ALOX5 (0.53) ALOX5PRKDCGGPS1PTGES2PDK2
SCHEMBL18272692 0.83 ALOX5 (0.50) ALOX5PRKDCGGPS1PTGES2PDK2
SCHEMBL23441898 0.82 AHR (0.41) ALOX5PRKDCAHRPDK2PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11832513-B2 Materials for electronic devices MERCK PATENT GMBH (DE) 2023-11-28 US disclosed
US-11832513-B2 Materials for electronic devices MERCK PATENT GMBH (DE) 2023-11-28 US disclosed
EP-4242286-A2 MATERIALS FOR ELECTRONIC DEVICES Merck Patent GmbH (DE) 2023-09-13 EP disclosed
EP-3714022-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2023-06-07 EP disclosed
US-20200303654-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-09-24 US disclosed
WO-2019101719-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2019-05-31 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 (2 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-11832513-B2 Materials for electronic devices PNMT, DDT, COMT ALOX5 2153/4885PRKDC 2492/4885GGPS1 2033/4885
US-20200303654-A1 MATERIALS FOR ELECTRONIC DEVICES PNMT, DDT, COMT ALOX5 2153/4885PRKDC 2492/4885GGPS1 2033/4885

“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.