SCHEMBL31037935

SCHEMBL31037935

O=c1c(I)coc2c1ccc1ccccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 4/20 0.62
▸ KMT2A Q03164 3/20 0.62
▸ PTPN1 P18031 2/20 0.62
▸ MEN1 O00255 1/20 0.62
▸ ALDH1A1 P00352 6/20 0.47
▸ MAPT P10636 5/20 0.47
▸ GAA P10253 1/20 0.47
▸ ABCG2 Q9UNQ0 5/20 0.44
▸ HPGD P15428 4/20 0.44
▸ MCL1 Q07820 1/20 0.44
▸ ABCC1 P33527 3/20 0.41
▸ KDM4E B2RXH2 4/20 0.40
▸ HTT P42858 3/20 0.40
▸ ESR1 P03372 1/20 0.40
▸ HSD17B10 Q99714 2/20 0.40
▸ CYP1A1 P04798 2/20 0.40
▸ CYP1B1 Q16678 2/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ PDE5A O76074 1/20 0.40
▸ TP53 P04637 1/20 0.40

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
SCHEMBL28569270 1.00 POLB (0.62) POLBKMT2APTPN1MEN1ALDH1A1
SCHEMBL29950744 0.77 PTPN1 (1.00) POLBKMT2APTPN1MEN1ALDH1A1
SCHEMBL11869804 0.77 POLB (0.59) POLBKMT2APTPN1MEN1ALDH1A1
SCHEMBL11872015 0.77 PTPN1 (1.00) POLBKMT2APTPN1MEN1ALDH1A1
SCHEMBL21591554 0.76 POLB (0.57) POLBKMT2APTPN1MEN1ALDH1A1
SCHEMBL11549451 0.76 POLB (0.57) POLBKMT2APTPN1MEN1ALDH1A1
SCHEMBL11510369 0.76 MAOB (0.59) POLBKMT2APTPN1MEN1ALDH1A1
SCHEMBL22445015 0.75 KMT2A (0.45) POLBKMT2APTPN1MEN1ALDH1A1
SCHEMBL29693511 0.75 POLB (0.63) POLBKMT2APTPN1MEN1ALDH1A1
SCHEMBL18312297 0.75 POLB (0.63) POLBKMT2APTPN1MEN1ALDH1A1

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-118406075-A Silicon-containing polycyclic chromone skeleton compound, preparation method and application thereof 遵义医科大学 2024-07-30 — — CN disclosed
CN-118255735-A Preparation method of cyclopenta [ b ] chromone compound 遵义医科大学 2024-06-28 — — CN disclosed
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