SCHEMBL22113569

SCHEMBL22113569

CC1(C)OB(c2ccccc2-c2ccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)cc2)OC1(C)C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LPL P06858 5/20 0.50
▸ LIPG Q9Y5X9 5/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GPR55 Q9Y2T6 1/20 0.38
▸ MAPT P10636 3/20 0.37
▸ LMNA P02545 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ TSHR P16473 3/20 0.36
▸ ADORA3 P0DMS8 2/20 0.36
▸ ALOX15 P16050 2/20 0.36
▸ ADORA2A P29274 2/20 0.36
▸ ADORA2B P29275 2/20 0.36
▸ ADORA1 P30542 2/20 0.36
▸ PDGFRB P09619 1/20 0.36
▸ KDR P35968 1/20 0.36
▸ HTT P42858 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 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
SCHEMBL20995888 0.93 LIPG (0.53) LPLLIPGL3MBTL1GPR55MAPT
SCHEMBL20995943 0.93 LIPG (0.53) LPLLIPGL3MBTL1GPR55MAPT
SCHEMBL38659382 0.93 LIPG (0.53) LPLLIPGL3MBTL1GPR55MAPT
SCHEMBL17529962 0.92 LPL (0.47) LPLLIPGL3MBTL1GPR55MAPT
SCHEMBL31156725 0.92 MEN1 (0.45) LPLLIPGL3MBTL1MAPTLMNA
SCHEMBL23105621 0.91 LPL (0.52) LPLLIPGL3MBTL1GPR55MAPT
SCHEMBL28567849 0.90 LIPG (0.48) LPLLIPGL3MBTL1MAPTLMNA
SCHEMBL31643436 0.90 LIPG (0.43) LPLLIPGL3MBTL1GPR55MAPT
SCHEMBL25799128 0.89 LIPG (0.62) LPLLIPGALDH1A1HPGDPDGFRB
SCHEMBL12390740 0.89 LIPG (0.56) LPLLIPGALDH1A1HPGDPDGFRB

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
CN-112912372-A Cyclic azine compound, material for organic electroluminescent element, electron transport material for organic electroluminescent element, and organic electroluminescent element 东曹株式会社 2021-06-04 — — CN disclosed
US-20200190070-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT INCLUDING SAME LG CHEM, LTD. (KR) 2020-06-18 — — 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-20200190070-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT INCLUDING SAME CRY1, CRY2, CYP1A1 LPL 4178/4885LIPG 4162/4885L3MBTL1 2241/4885

“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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