SCHEMBL17816922

SCHEMBL17816922

CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4cccc5c4sc4ccccc45)cc3)c3ccc(C4(c5ccccc5)c5ccccc5-c5ccccc5-c5ccccc54)cc3)cc21

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.39
PRKDC P78527 1/20 0.32
PARP14 Q460N5 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
SCHEMBL17804856 0.99 ALOX5 (0.40) ALOX5PRKDCPARP14
SCHEMBL16996182 0.97 ALOX5 (0.40) ALOX5PRKDCPARP14
SCHEMBL9916369 0.96 ALOX5 (0.39) ALOX5PRKDCPARP14
SCHEMBL19735549 0.95 ALOX5 (0.38) ALOX5PRKDCPARP14
SCHEMBL24434024 0.95 ALOX5 (0.39) ALOX5PRKDCPARP14
SCHEMBL20127774 0.95 ALOX5 (0.39) ALOX5PRKDCPARP14
SCHEMBL21763224 0.95 ALOX5 (0.36) ALOX5
SCHEMBL24433993 0.95 ALOX5 (0.37) ALOX5PRKDC
SCHEMBL20346013 0.94 ALOX5 (0.38) ALOX5PRKDCPARP14
SCHEMBL18468900 0.94 ALOX5 (0.38) ALOX5PRKDCPARP14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 1985/4885PRKDC 4584/4885PARP14 2946/4885
US-10573818-B2 Materials for organic electroluminescent devices PIEZO1, LEF1, EFNA1 ALOX5 1985/4885PRKDC 4584/4885PARP14 2946/4885

“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.