SCHEMBL20172985

SCHEMBL20172985

CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)C3(c5ccccc5-4)c4ccccc4-c4cc5c6ccccc6c6ccccc6c5cc43)c3cccc4ccccc34)cc21

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.31
SIGMAR1 Q99720 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
SCHEMBL808074 0.94 SIGMAR1 (0.34) PDK2SIGMAR1
SCHEMBL21558966 0.93 PDK2 (0.33) PDK2SIGMAR1
SCHEMBL20762697 0.92 SIGMAR1 (0.33) PDK2SIGMAR1
SCHEMBL25563426 0.90 SIGMAR1 (0.34) PDK2SIGMAR1
SCHEMBL17081234 0.90 HPRT1 (0.33) PDK2
SCHEMBL14073300 0.90 SIGMAR1 (0.34) PDK2SIGMAR1
SCHEMBL25562984 0.90 SIGMAR1 (0.34) PDK2SIGMAR1
SCHEMBL23155333 0.90 PDK2 (0.33) PDK2SIGMAR1
SCHEMBL15138131 0.90 SIGMAR1 (0.36) PDK2SIGMAR1
SCHEMBL21559039 0.89 SIGMAR1 (0.34) PDK2SIGMAR1

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-10651411-B2 Compound and organic light emitting device containing same LG CHEM, LTD. (KR) 2020-05-12 US disclosed
US-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME LG CHEM, LTD. (KR) 2018-05-24 US disclosed
US-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME LG CHEM, LTD. (KR) 2018-05-24 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-20180145272-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE CONTAINING SAME CRY1, CRY2, OR10J3 PDK2 2535/4885SIGMAR1 1467/4885
US-10651411-B2 Compound and organic light emitting device containing same CRY1, CRY2, OR10J3 PDK2 2535/4885SIGMAR1 1467/4885

“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.