SCHEMBL29846704

SCHEMBL29846704

ON=Cc1nccc2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NCOA3 Q9Y6Q9 1/20 0.59
▸ PLAU P00749 2/20 0.46
▸ PLG P00747 1/20 0.46
▸ CYP2A6 P11509 1/20 0.46
▸ F12 P00748 1/20 0.46
▸ NCF1 P14598 1/20 0.46
▸ NOS3 P29474 1/20 0.46
▸ NOS1 P29475 1/20 0.46
▸ NOS2 P35228 1/20 0.46
▸ BACE1 P56817 1/20 0.46
▸ S100A4 P26447 1/20 0.45
▸ NQO2 P16083 1/20 0.45
▸ KDM4E B2RXH2 3/20 0.42
▸ HPGD P15428 2/20 0.42
▸ LMNA P02545 3/20 0.41
▸ CFTR P13569 1/20 0.41
▸ GOPC Q9HD26 1/20 0.41
▸ NPC1 O15118 4/20 0.41
▸ RAB9A P51151 4/20 0.41
▸ CYP3A4 P08684 2/20 0.39

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
SCHEMBL11723189 1.00 NCOA3 (0.59) NCOA3PLAUPLGCYP2A6F12
SCHEMBL11723196 1.00 NCOA3 (0.59) NCOA3PLAUPLGCYP2A6F12
SCHEMBL4254681 0.80 NCOA3 (0.54) NCOA3PLAUPLGCYP2A6F12
SCHEMBL4254677 0.80 NCOA3 (0.54) NCOA3PLAUPLGCYP2A6F12
SCHEMBL13380986 0.76 NCOA3 (0.77) NCOA3PLAUPLGF12NCF1
SCHEMBL29773648 0.75 NCOA3 (1.00) NCOA3KDM4ELMNAALDH1A1MAPT
SCHEMBL31237388 0.75 NCOA3 (1.00) NCOA3KDM4ELMNAALDH1A1MAPT
SCHEMBL13927328 0.75 NCOA3 (1.00) NCOA3KDM4ELMNAALDH1A1MAPT
SCHEMBL782069 0.75 NCOA3 (1.00) NCOA3KDM4ELMNAALDH1A1MAPT
SCHEMBL25417027 0.75 PLAU (0.50) NCOA3PLAUPLGCYP2A6F12

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-20250002487-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF VENTUS THERAPEUTICS U.S., INC. (US) 2025-01-02 — — US disclosed
WO-2022123530-A1 BORONIC ACID COMPOUND 주식회사 엘지화학 2022-06-16 — — 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 (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-20250002487-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF CGAS, TDP1, CYP11B2 NCOA3 3148/4885PLAU 3206/4885PLG 4387/4885

“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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