SCHEMBL19166138

SCHEMBL19166138

c1ccc(-c2ccc(N(c3ccc4c(c3)C3(c5ccccc5-c5ccccc5-4)c4ccccc4-c4ccccc43)c3cccc4oc5ccccc5c34)cc2)cc1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.31
PLA2G2A P14555 2/20 0.30
PLA2G4A P47712 2/20 0.30
ALOX5 P09917 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
SCHEMBL19168748 1.00 PDK2 (0.31) PDK2PLA2G2APLA2G4AALOX5
SCHEMBL21094666 0.99 PDK2 (0.32) PDK2PLA2G2APLA2G4AALOX5
SCHEMBL21095297 0.97 PDK2 (0.35) PDK2PLA2G2APLA2G4A
SCHEMBL21094810 0.97 PDK2 (0.35) PDK2PLA2G2APLA2G4A
SCHEMBL25563359 0.97 PDK2 (0.30) PDK2PLA2G2APLA2G4A
SCHEMBL21094805 0.96 PDK2 (0.34) PDK2PLA2G2APLA2G4A
SCHEMBL21095298 0.96 PDK2 (0.34) PDK2PLA2G2APLA2G4A
SCHEMBL19166885 0.96 PDK2 (0.36) PDK2PLA2G2APLA2G4AALOX5
SCHEMBL19167705 0.96 PDK2 (0.36) PDK2PLA2G2APLA2G4AALOX5
SCHEMBL19394680 0.95 AHR (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10424744-B2 Compound and organic electronic device comprising the same SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2019-09-24 US disclosed
US-20170213971-A1 Novel compound and organic electronic device comprising the same SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2017-07-27 US disclosed
US-20170213971-A1 Novel compound and organic electronic device comprising the same SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2017-07-27 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 (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-10424744-B2 Compound and organic electronic device comprising the same CHRM1, CHRM2, ESR1 PDK2 2514/4885PLA2G2A 1570/4885PLA2G4A 2409/4885
US-20170213971-A1 Novel compound and organic electronic device comprising the same CHRM1, CHRM2, ESR1 PDK2 2806/4885PLA2G2A 1330/4885PLA2G4A 2323/4885

“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.