SCHEMBL17816786

SCHEMBL17816786

c1ccc(-c2ccc(N(c3ccc(-c4cccc5c4oc4ccccc45)cc3)c3cccc4c3-c3ccccc3C43c4ccccc4-c4ccccc4-c4ccccc43)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.41
GGPS1 O95749 1/20 0.34
PTGES2 Q9H7Z7 1/20 0.32
PRKDC P78527 1/20 0.32
CDC14B O60729 1/20 0.31
CDC14A Q9UNH5 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
SCHEMBL20806313 1.00 ALOX5 (0.41) ALOX5GGPS1PTGES2PRKDCCDC14B
SCHEMBL16544696 1.00 ALOX5 (0.41) ALOX5GGPS1PTGES2PRKDCCDC14B
SCHEMBL18160218 0.99 ALOX5 (0.40) ALOX5GGPS1PTGES2PRKDCCDC14B
SCHEMBL23222846 0.97 ALOX5 (0.40) ALOX5GGPS1PTGES2PRKDCCDC14B
SCHEMBL18457649 0.97 ALOX5 (0.42) ALOX5GGPS1PTGES2PRKDC
SCHEMBL17816931 0.97 ALOX5 (0.43) ALOX5GGPS1PTGES2PRKDC
SCHEMBL25145474 0.97 ALOX5 (0.43) ALOX5GGPS1PTGES2PRKDC
SCHEMBL24905255 0.96 ALOX5 (0.41) ALOX5GGPS1PTGES2PRKDC
SCHEMBL18457544 0.96 ALOX5 (0.43) ALOX5GGPS1PTGES2PRKDC
SCHEMBL25121454 0.95 ALOX5 (0.40) ALOX5GGPS1PTGES2PRKDCCDC14B

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-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-10431751-B2 Compound and organic electronic device comprising the same SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2019-10-01 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
US-20170213970-A1 Novel compound and organic electronic device comprising the same SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2017-07-27 US disclosed
US-20170213970-A1 Novel compound and organic electronic device comprising the same SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2017-07-27 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 (4 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-10431751-B2 Compound and organic electronic device comprising the same CHRM1, CHRM2, ESR1 ALOX5 2114/4885GGPS1 2471/4885PTGES2 1965/4885
US-20170213970-A1 Novel compound and organic electronic device comprising the same CHRM1, CHRM2, ESR1 ALOX5 2171/4885GGPS1 2783/4885PTGES2 2374/4885
US-20170317283-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES PIEZO1, LEF1, EFNA1 ALOX5 1985/4885GGPS1 787/4885PTGES2 1270/4885
US-10573818-B2 Materials for organic electroluminescent devices PIEZO1, LEF1, EFNA1 ALOX5 1985/4885GGPS1 787/4885PTGES2 1270/4885

“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.