SCHEMBL25444663

SCHEMBL25444663

CCCCCCCCC1(CCCCCCCC)c2cc(-c3ccc(OC(C)C)cc3)ccc2-c2ccc(-c3ccc(-c4ccc5c(c4)C(CCCCCCCC)(CCCCCCCC)c4cc(-c6ccc(N(c7ccccc7)c7ccccc7)cc6)ccc4-5)c4nsnc34)cc21

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 2/20 0.31
▸ MCL1 Q07820 3/20 0.31
▸ ESR1 P03372 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ NPC1 O15118 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ RAB9A P51151 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
SCHEMBL25444661 0.92 MCL1 (0.33) PDK2MCL1MAPT
SCHEMBL25444726 0.92 MCL1 (0.33) PDK2MCL1MAPT
SCHEMBL25444662 0.92 MCL1 (0.33) PDK2MCL1MAPT
SCHEMBL25444648 0.92 MCL1 (0.33) PDK2MCL1MAPT
SCHEMBL25444643 0.91 MCL1 (0.32) PDK2MCL1MAPT
SCHEMBL25444652 0.91 MMP2 (0.32) PDK2ESR1
SCHEMBL14369620 0.91 MMP2 (0.32) PDK2ESR1
SCHEMBL25444646 0.89 ESR1 (0.32) ESR1
SCHEMBL25444701 0.89 PDK2 (0.32) PDK2MCL1MAPT
SCHEMBL25444698 0.88 PDK2 (0.38) PDK2KDM4ENPC1ALDH1A1MAPT

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-20230143779-A1 ORGANIC SOLID-STATE LASER, COMPOUND AND USE THEREOF KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2023-05-11 — — 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-20230143779-A1 ORGANIC SOLID-STATE LASER, COMPOUND AND USE THEREOF LEF1, CCNT1, CCNT2 PDK2 3407/4885MCL1 1322/4885ESR1 148/4885

“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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