SCHEMBL11929619

SCHEMBL11929619

C=c1c2ccccc2n2c3ccc(C(=O)c4ccc5c(c4)c4cccc6c4n5-c4ccccc4C6(C)C)cc3c3cccc1c32

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.30
▸ CNR1 P21554 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
SCHEMBL11901193 0.88 CNR2 (0.40) CNR2KDM4EALDH1A1HPGDLMNA
SCHEMBL11926604 0.85 CNR2 (0.46) CNR2KDM4EALDH1A1HPGDLMNA
SCHEMBL13974277 0.78 — —
SCHEMBL19228177 0.76 MAPT (0.32) CNR2KDM4EALDH1A1LMNAMAPT
SCHEMBL11926517 0.75 PDK2 (0.39) CNR2KDM4EALDH1A1LMNAMAPT
SCHEMBL11926506 0.74 PDK2 (0.39) CNR2KDM4EALDH1A1LMNAMAPT
SCHEMBL11926659 0.74 PDK2 (0.37) CNR2KDM4EALDH1A1HPGDSMN1; SMN2
SCHEMBL11926518 0.74 PDK2 (0.38) CNR2KDM4ELMNAMAPTCNR1
SCHEMBL11926654 0.74 CNR2 (0.38) CNR2KDM4EALDH1A1HPGDLMNA
SCHEMBL11926515 0.73 CNR2 (0.38) CNR2KDM4EALDH1A1LMNAMAPT

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-20120202997-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2012-08-09 — — 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-20120202997-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES EPCAM, L1CAM, OR10J3 CNR2 3281/4885KDM4E 3239/4885ALDH1A1 136/4885

“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.

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