SCHEMBL22182403

SCHEMBL22182403

CC1(C)c2ccccc2-c2cccc(-c3cccc(N(c4ccc(-c5cccc(-c6ccccc6)c5)cc4)c4cccc(-c5cccc6c5C(C)(C)c5ccccc5-6)c4)c3)c21

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 10/20 0.36
▸ RARB P10826 2/20 0.33
▸ RARG P13631 2/20 0.33
▸ RARA P10276 1/20 0.33
▸ TDP2 O95551 1/20 0.31
▸ PTGER1 P34995 1/20 0.31
▸ PTGER4 P35408 1/20 0.31
▸ PTGER3 P43115 1/20 0.31
▸ PTGER2 P43116 1/20 0.31
▸ ACMSD Q8TDX5 1/20 0.31
▸ BRD4 O60885 1/20 0.30
▸ CREBBP Q92793 1/20 0.30
▸ RXRA P19793 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
SCHEMBL24156279 0.97 PDK2 (0.35) PDK2RARBRARGTDP2RXRA
SCHEMBL24156387 0.97 PDK2 (0.35) PDK2RARBRARGTDP2RXRA
SCHEMBL18998381 0.96 PDK2 (0.38) PDK2RARBRARGRARATDP2
SCHEMBL22182398 0.95 PDK2 (0.36) PDK2RARBRARGRARATDP2
SCHEMBL26279065 0.94 PDK2 (0.39) PDK2
SCHEMBL26285596 0.94 PDK2 (0.39) PDK2
SCHEMBL26279009 0.94 PDK2 (0.39) PDK2
SCHEMBL22182385 0.93 RARB (0.36) PDK2RARBRARGRXRA
SCHEMBL24155971 0.93 PDK2 (0.32) PDK2RARBRARGRXRA
SCHEMBL22182397 0.93 PDK2 (0.33) PDK2RARBRARGRXRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210408381-A1 COMPOUND, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE LT MATERIALS CO., LTD. (KR) 2021-12-30 — — US disclosed
WO-2020138837-A1 COMPOSITION, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE 엘티소재주식회사 2020-07-02 — — WO 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-20210408381-A1 COMPOUND, ORGANIC OPTOELECTRONIC DEVICE, AND DISPLAY DEVICE OXER1, OR10J3, OR51E2 PDK2 2490/4885RARB 377/4885RARG 897/4885

“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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