SCHEMBL25444698

SCHEMBL25444698

CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2ccc(-c3ccc(-c4ccc(OC(C)C)cc4)c4nsnc34)cc21

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 10/20 0.38
▸ PPARA Q07869 1/20 0.32
▸ ALOX5AP P20292 2/20 0.31
▸ FEN1 P39748 2/20 0.31
▸ 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
▸ PTPN11 Q06124 2/20 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
SCHEMBL25444701 0.95 PDK2 (0.32) PDK2MAPTPTPN11
SCHEMBL25444643 0.93 MCL1 (0.32) PDK2MAPTPTPN11
SCHEMBL25444648 0.92 MCL1 (0.33) PDK2MAPT
SCHEMBL25444726 0.92 MCL1 (0.33) PDK2MAPT
SCHEMBL25444661 0.92 MCL1 (0.33) PDK2MAPT
SCHEMBL25444662 0.92 MCL1 (0.33) PDK2MAPT
SCHEMBL25444635 0.89 PDK2 (0.37) PDK2ALOX5APFEN1PTPN11
SCHEMBL22402534 0.89 PDK2 (0.37) PDK2ALOX5APFEN1PTPN11
SCHEMBL25444633 0.89 PDK2 (0.37) PDK2ALOX5APFEN1PTPN11
SCHEMBL5354304 0.89 PDK2 (0.37) PDK2ALOX5APFEN1PTPN11

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-20230143779-A1 ORGANIC SOLID-STATE LASER, COMPOUND AND USE THEREOF KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2023-05-11 — — US disclosed
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 3407/4885PPARA 3320/4885ALOX5AP 1080/4885

“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.

Send feedback