SCHEMBL13699276

SCHEMBL13699276

O=C1OC(=O)c2cc(OCOc3ccc4c(c3)C(=O)OC4=O)ccc21

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
MAOA P21397 10/20 0.44
MAOB P27338 10/20 0.44
ALDH1A1 P00352 1/20 0.43
TOP1 P11387 1/20 0.41
MAPT P10636 1/20 0.37
CHRNA7 P36544 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL12556379 0.89 MAOA (0.40) ALOX15TDP1MAOAMAOBALDH1A1
SCHEMBL26017981 0.88 MAOB (0.40) MAOAMAOBALDH1A1TOP1
SCHEMBL31154479 0.88 MAOA (0.49) ALOX15TDP1MAOAMAOBALDH1A1
SCHEMBL12337779 0.88 MAOA (0.49) ALOX15TDP1MAOAMAOBALDH1A1
SCHEMBL24948319 0.86 MAOA (0.50) ALOX15TDP1MAOAMAOBALDH1A1
SCHEMBL17250895 0.86 MAOA (0.50) ALOX15TDP1MAOAMAOBALDH1A1
SCHEMBL20251189 0.85 MAOA (0.49) MAOAMAOBALDH1A1MAPTKMT2A
SCHEMBL10328389 0.85 MAPT (0.51) ALOX15TDP1MAOAMAOBALDH1A1
SCHEMBL20251164 0.85 MAOA (0.49) MAOAMAOBALDH1A1MAPTKMT2A
SCHEMBL24946581 0.85 MAOA (0.49) MAOAMAOBALDH1A1MAPTKMT2A

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-2024114613-A1 ALLOY NEGATIVE ELECTRODE MATERIAL AND PREPARATION METHOD THEREFOR, NEGATIVE ELECTRODE MATERIAL SYSTEM, NEGATIVE ELECTRODE SHEET AND LITHIUM-ION BATTERY 华为技术有限公司 2024-06-06 WO disclosed
CN-118099359-A Alloy negative electrode material, preparation method thereof, negative electrode material system, negative electrode plate and lithium ion battery 华为技术有限公司 2024-05-28 CN disclosed
US-20090231518-A1 OPTICAL FILM, POLARIZATION PLATE AND LIQUID CRYSTAL DISPALY JSR CORPORATION (JP) 2009-09-17 US disclosed