SCHEMBL17081240

SCHEMBL17081240

c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5c4oc4ccccc45)c4c3ccc3ccccc34)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.40
▸ TDP1 Q9NUW8 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ PRKDC P78527 5/20 0.33
▸ PIK3CD O00329 1/20 0.33
▸ PIK3CB P42338 1/20 0.33
▸ ABCG2 Q9UNQ0 5/20 0.33
▸ CYP1A1 P04798 4/20 0.33
▸ CYP1A2 P05177 4/20 0.33
▸ GGPS1 O95749 1/20 0.33
▸ FYN P06241 1/20 0.33
▸ MAPK3 P27361 1/20 0.33
▸ AHR P35869 1/20 0.33
▸ PAX8 Q06710 1/20 0.33
▸ ARSA P15289 1/20 0.32
▸ CDC25A P30304 1/20 0.32
▸ CDC25C P30307 1/20 0.32
▸ CDC14B O60729 1/20 0.31
▸ CDC14A Q9UNH5 1/20 0.31
▸ PTGES2 Q9H7Z7 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
SCHEMBL18383250 0.95 ALOX5 (0.41) ALOX5TDP1L3MBTL1PRKDCPIK3CD
SCHEMBL20435190 0.89 ALOX5 (0.40) ALOX5TDP1L3MBTL1PRKDCPIK3CD
SCHEMBL17081285 0.89 ALOX5 (0.50) ALOX5TDP1L3MBTL1PRKDCABCG2
SCHEMBL26373335 0.88 ALOX5 (0.39) ALOX5TDP1L3MBTL1PRKDCPIK3CD
SCHEMBL12206336 0.88 ALOX5 (0.43) ALOX5TDP1L3MBTL1PRKDCPIK3CD
SCHEMBL12206320 0.88 ALOX5 (0.44) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL25089613 0.87 ALOX5 (0.42) ALOX5TDP1L3MBTL1PRKDCPIK3CD
SCHEMBL26356952 0.87 ALOX5 (0.42) ALOX5TDP1L3MBTL1PRKDCPIK3CD
SCHEMBL17126682 0.86 ALOX5 (0.47) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL24658098 0.86 ALOX5 (0.41) ALOX5TDP1L3MBTL1PRKDCPIK3CD

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-20200303649-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-09-24 — — US disclosed
US-10727413-B2 Materials for electronic devices MERCK PATENT GMBH (DE) 2020-07-28 — — US disclosed
EP-3114102-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-12-06 — — EP disclosed
US-20170018710-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-01-19 — — US disclosed
US-20170018710-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2017-01-19 — — US disclosed
WO-2015131976-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2015-09-11 — — 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-10727413-B2 Materials for electronic devices EED, OCIAD2, JUND ALOX5 637/4885TDP1 944/4885L3MBTL1 1626/4885
US-20200303649-A1 MATERIALS FOR ELECTRONIC DEVICES EED, OCIAD2, JUND ALOX5 637/4885TDP1 944/4885L3MBTL1 1626/4885
US-20170018710-A1 MATERIALS FOR ELECTRONIC DEVICES EED, OCIAD2, JUND ALOX5 637/4885TDP1 944/4885L3MBTL1 1626/4885

“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.

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