SCHEMBL4730217

SCHEMBL4730217

O=C(O)C(=O)N1C2=CC=CCC2=Cc2ccccc21

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ P2RX4 Q99571 13/20 0.35
▸ P2RX1 P51575 5/20 0.33
▸ P2RX3 P56373 5/20 0.33
▸ P2RX7 Q99572 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ SCN4A P35499 1/20 0.33
▸ SCN5A Q14524 1/20 0.33
▸ SCN9A Q15858 1/20 0.33
▸ RBP4 P02753 1/20 0.33
▸ PTBP1 P26599 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ MTNR1A P48039 1/20 0.31
▸ MTNR1B P49286 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
SCHEMBL10840905 0.85 P2RX4 (0.36) P2RX4P2RX1P2RX3P2RX7LMNA
SCHEMBL1552327 0.82 GSK3B (0.38) P2RX4P2RX1P2RX3P2RX7LMNA
SCHEMBL20291578 0.77 CA12 (0.39) SMN1; SMN2MTNR1AMTNR1B
SCHEMBL284852 0.77 SMN1; SMN2 (0.39) TSHRSMN1; SMN2NPSR1
SCHEMBL7757567 0.77 — —
SCHEMBL10841349 0.75 GLA (0.35) SMN1; SMN2
SCHEMBL3730203 0.75 GPR84 (0.35) —
SCHEMBL5401292 0.71 — —
SCHEMBL7035805 0.71 — —
SCHEMBL8060205 0.71 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008121029-A2 USE OF 9-OXOACRIDINE-10-ACETIC ACID AND/OR SALTS AND/OR ITS ESTERS THEREOF FOR THE TREATMENT AND PROPHYLAXIS OF MALIGNANT TUMORS OF FEMALE REPRODUCTIVE SYSTEM SURKOV KIRILL GENNEDIEVICH (RU) 2008-10-09 — — WO claimed
WO-2008121028-A2 USE OF 9-OXOACRIDINE-10-ACETIC ACID, SALTS AND ESTERS THEREOF IN COMBINATION THERAPY OF OVARIAN CANCER SURKOV KIRILL GENNEDIEVICH (RU) 2008-10-09 — — WO claimed
WO-2008024027-A2 USE OF 9-OXOACRIDINE-10-ACETIC ACID, ITS SALTS AND ESTERS FOR ENHANCING THE EFFICACY OF ANTIANDROGENIC TREATMENT SURKOV KIRILL GENNADIEVICH (RU) 2008-02-28 — — WO claimed
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