SCHEMBL22845313

SCHEMBL22845313

CC(C)(O)C(C)(C)OBc1ccc2c(c1)oc1cccc(-c3ccccc3)c12

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CDC14B O60729 1/20 0.32
CDC14A Q9UNH5 1/20 0.32
CA12 O43570 1/20 0.32
ALDH2 P05091 1/20 0.32
AKR1B1 P15121 1/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
HSD17B3 P37058 1/20 0.32
SORD Q00796 1/20 0.32
CA9 Q16790 1/20 0.32
ALDH1A1 P00352 2/20 0.31
HPGD P15428 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
USP2 O75604 1/20 0.31
ADRB2 P07550 1/20 0.31

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
SCHEMBL24065324 0.95 ALDH1A1 (0.31) ALDH1A1
SCHEMBL27451690 0.93 WEE1 (0.34) CDC14BCDC14AALDH1A1HPGD
SCHEMBL27451757 0.91 WEE1 (0.33)
SCHEMBL21756018 0.90 ALOX5 (0.34) CDC14BCDC14AMAOAHPGDADRB2
SCHEMBL23098282 0.90 KMT2A (0.32) CA12ALDH2AKR1B1MAOAMAOB
SCHEMBL21650705 0.90 ADRB2 (0.34) CDC14BCDC14AMAOAL3MBTL1ADRB2
SCHEMBL25707171 0.89 ALDH1A1 (0.31) CDC14BCDC14AALDH1A1HPGDUSP2
SCHEMBL27451754 0.89 WEE1 (0.33)
SCHEMBL27452248 0.85 PLA2G2A (0.33) ALDH1A1
SCHEMBL25717487 0.84 PPARG (0.33)

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
WO-2023113389-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER OF ORGANIC LIGHT-EMITTING ELEMENT 엘티소재주식회사 2023-06-22 WO disclosed
US-20200407348-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2020-12-31 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-20200407348-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE OCIAD1, OXER1, OCIAD2 CDC14B 3354/4885CDC14A 3678/4885CA12 685/4885

“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.