SCHEMBL17816698

SCHEMBL17816698

c1ccc(-c2ccc(N(c3ccc(-c4cccc5c4oc4ccccc45)cc3)c3ccc(C4(c5ccccc5)c5ccccc5-c5ccccc5-c5ccccc54)cc3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.43
GGPS1 O95749 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
OPRK1 P41145 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PRKDC P78527 2/20 0.33
PTGES2 Q9H7Z7 1/20 0.33
CDC14B O60729 1/20 0.32
CDC14A Q9UNH5 1/20 0.32
ESR1 P03372 1/20 0.30
ESR2 Q92731 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
SCHEMBL17816788 1.00 ALOX5 (0.43) ALOX5GGPS1KDM4EMEN1LMNA
SCHEMBL17126404 0.99 ALOX5 (0.43) ALOX5GGPS1KDM4EMEN1LMNA
SCHEMBL17804920 0.99 ALOX5 (0.43) ALOX5GGPS1KDM4EMEN1LMNA
SCHEMBL17804841 0.99 ALOX5 (0.43) ALOX5GGPS1KDM4EMEN1LMNA
SCHEMBL29789474 0.99 ALOX5 (0.43) ALOX5GGPS1KDM4EMEN1LMNA
SCHEMBL17805105 0.98 ALOX5 (0.44) ALOX5GGPS1KDM4EMEN1LMNA
SCHEMBL17804866 0.97 ALOX5 (0.43) ALOX5GGPS1KDM4EMEN1LMNA
SCHEMBL17804838 0.97 ALOX5 (0.45) ALOX5GGPS1KDM4EMEN1LMNA
SCHEMBL17804876 0.97 ALOX5 (0.45) ALOX5GGPS1KDM4EMEN1LMNA
SCHEMBL17805047 0.96 ALOX5 (0.44) ALOX5GGPS1KDM4EMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3227269-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-02-26 EP disclosed
US-10573818-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2020-02-25 US disclosed
US-20170317283-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-11-02 US disclosed
US-20170317283-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2017-11-02 US disclosed
WO-2016087017-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2016-06-09 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-20170317283-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES PIEZO1, LEF1, EFNA1 ALOX5 1985/4885GGPS1 787/4885KDM4E 2668/4885
US-10573818-B2 Materials for organic electroluminescent devices PIEZO1, LEF1, EFNA1 ALOX5 1985/4885GGPS1 787/4885KDM4E 2668/4885

“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.