SCHEMBL20470710

SCHEMBL20470710

CC1(C)c2cc(-c3cccc(-c4ccc(N(c5ccc(-c6ccc(N(c7ccc(-c8ccccc8)cc7)c7cccc8ccccc78)cc6)cc5)c5cccc6ccccc56)cc4)c3)ccc2-c2ccc(N(c3ccccc3)c3ccc4c(c3)C(C)(C)c3cc(N(c5ccccc5)c5cccc6ccccc56)ccc3-4)cc21

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ SIGMAR1 Q99720 5/20 0.34
▸ PDK2 Q15119 3/20 0.33
▸ CA12 O43570 3/20 0.31
▸ CA1 P00915 3/20 0.31
▸ CA2 P00918 3/20 0.31
▸ CA9 Q16790 3/20 0.31
▸ PGR P06401 2/20 0.31
▸ SLC6A9 P48067 1/20 0.31
▸ RARA P10276 1/20 0.30
▸ RARB P10826 1/20 0.30
▸ RARG P13631 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
SCHEMBL15495875 0.99 SIGMAR1 (0.35) SIGMAR1PDK2CA12CA1CA2
SCHEMBL15495919 0.99 SIGMAR1 (0.35) SIGMAR1PDK2CA12CA1CA2
SCHEMBL15495814 0.99 SIGMAR1 (0.35) SIGMAR1PDK2CA12CA1CA2
SCHEMBL15495810 0.99 SIGMAR1 (0.35) SIGMAR1PDK2CA12CA1CA2
SCHEMBL15496142 0.99 SIGMAR1 (0.35) SIGMAR1PDK2CA12CA1CA2
SCHEMBL18436006 0.98 SIGMAR1 (0.33) SIGMAR1PDK2CA12CA1CA2
SCHEMBL17153719 0.98 PDK2 (0.34) SIGMAR1PDK2CA12CA1CA2
SCHEMBL15495893 0.98 SIGMAR1 (0.33) SIGMAR1PDK2CA12CA1CA2
SCHEMBL16366106 0.98 SIGMAR1 (0.36) SIGMAR1PDK2CA12CA1CA2
SCHEMBL15495861 0.98 SIGMAR1 (0.36) SIGMAR1PDK2CA12CA1CA2

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-20180226601-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, ILLUMINATION DEVICE, DISPLAY DEVICE, AND MIXED MATERIAL IDEMITSU KOSAN CO., LTD. (JP) 2018-08-09 — — 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-20180226601-A1 ORGANIC ELECTROLUMINESCENT ELEMENT, ILLUMINATION DEVICE, DISPLAY DEVICE, AND MIXED MATERIAL TMEM109, L1CAM, CD99 SIGMAR1 1110/4885PDK2 1665/4885CA12 767/4885

“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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