SCHEMBL22934102

SCHEMBL22934102

CC1(C)CCC(C)(C)c2cc(Nc3cccc4c3oc3ccccc34)ccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.38
HPGD P15428 4/20 0.38
RAB9A P51151 3/20 0.38
MEN1 O00255 11/20 0.36
KMT2A Q03164 11/20 0.36
CYP26A1 O43174 2/20 0.36
CYP3A4 P08684 2/20 0.36
RARA P10276 2/20 0.36
RARB P10826 2/20 0.36
RARG P13631 2/20 0.36
PGR P06401 1/20 0.36
ADORA3 P0DMS8 1/20 0.36
TBXA2R P21731 1/20 0.36
BLVRB P30043 1/20 0.36
KDM4E B2RXH2 5/20 0.36
HTT P42858 2/20 0.36
SMN1; SMN2 Q16637 4/20 0.35
LMNA P02545 2/20 0.35
CYP2C19 P33261 2/20 0.35
MAPT P10636 4/20 0.34

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
SCHEMBL25810324 0.93 MEN1 (0.35) ALDH1A1HPGDRAB9AMEN1KMT2A
SCHEMBL23567557 0.93 ALDH1A1 (0.38) ALDH1A1HPGDRAB9AMEN1KMT2A
SCHEMBL22936577 0.87 CYP26A1 (0.34) ALDH1A1HPGDRAB9AMEN1KMT2A
SCHEMBL22938422 0.86 ALDH1A1 (0.38) ALDH1A1HPGDRAB9AMEN1KMT2A
SCHEMBL25810283 0.85 ALDH1A1 (0.36) ALDH1A1HPGDRAB9AMEN1KMT2A
SCHEMBL25810346 0.84 MEN1 (0.38) ALDH1A1HPGDRAB9AMEN1KMT2A
SCHEMBL23439452 0.83 ALDH1A1 (0.43) ALDH1A1HPGDMEN1KMT2APGR
SCHEMBL23421685 0.82 MEN1 (0.40) ALDH1A1HPGDRAB9AMEN1KMT2A
SCHEMBL23421632 0.82 KMT2A (0.45) ALDH1A1HPGDRAB9AMEN1KMT2A
SCHEMBL30388350 0.82 KMT2A (0.45) ALDH1A1HPGDRAB9AMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230002420-A1 ORGANIC LIGHT-EMITTING ELEMENT LG CHEM, LTD. (KR) 2023-01-05 US disclosed
US-20220399501-A1 ORGANIC LIGHT-EMITTING ELEMENT LG CHEM, LTD. (KR) 2022-12-15 US disclosed
WO-2021107711-A1 POLYCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2021-06-03 WO disclosed
WO-2021020931-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-02-04 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 (2 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-20230002420-A1 ORGANIC LIGHT-EMITTING ELEMENT CYBA, CRY1, CYP1A1 ALDH1A1 94/4885HPGD 3047/4885RAB9A 3777/4885
US-20220399501-A1 ORGANIC LIGHT-EMITTING ELEMENT CYP1A1, AHR, CYP1B1 ALDH1A1 145/4885HPGD 2571/4885RAB9A 4090/4885

“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.