SCHEMBL21742671

SCHEMBL21742671

Cc1cccc2c1-c1ccc(-c3cccc4c3oc3ccccc34)cc1C2(C)C

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.50
PRKDC P78527 4/20 0.41
GGPS1 O95749 1/20 0.39
PTGES2 Q9H7Z7 1/20 0.39
PGR P06401 1/20 0.36
PDK2 Q15119 3/20 0.36
MEN1 O00255 1/20 0.34
CYP2C19 P33261 1/20 0.34
KMT2A Q03164 1/20 0.34
MAOA P21397 1/20 0.33
AVPR1A P37288 1/20 0.33
ALK Q9UM73 2/20 0.32
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
ATM Q13315 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
SCHEMBL12324541 0.88 ALOX5 (0.57) ALOX5PRKDCGGPS1PTGES2PGR
SCHEMBL20276869 0.88 ALOX5 (0.59) ALOX5PRKDCGGPS1PTGES2PGR
SCHEMBL21037803 0.87 ALOX5 (0.49) ALOX5PRKDCGGPS1PTGES2PGR
SCHEMBL21742872 0.87 ALOX5 (0.49) ALOX5PRKDCGGPS1PTGES2PGR
SCHEMBL21742727 0.87 ALOX5 (0.49) ALOX5PRKDCGGPS1PTGES2PGR
SCHEMBL21742876 0.87 PDK2 (0.36) ALOX5PGRPDK2MAOAALK
SCHEMBL16017825 0.87 ALOX5 (0.56) ALOX5PRKDCGGPS1PTGES2PGR
SCHEMBL21742674 0.86 HPGD (0.40) PRKDCPGRPDK2MEN1KMT2A
SCHEMBL21742873 0.86 MAOA (0.39) ALOX5PGRPDK2MEN1CYP2C19
SCHEMBL21164748 0.85 ALOX5 (0.47) ALOX5PRKDCGGPS1PTGES2PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200055822-A1 MATERIALS FOR ORGANIC ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-02-20 US 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 (1 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-20200055822-A1 MATERIALS FOR ORGANIC ELECTRONIC DEVICES PNMT, DDT, TYR ALOX5 2532/4885PRKDC 3014/4885GGPS1 2508/4885

“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.