SCHEMBL9682430

SCHEMBL9682430

COc1cccc(C(=O)Oc2ccc3c(c2)C(=O)OC3=O)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.62
▸ ESR2 Q92731 1/20 0.62
▸ KMT2A Q03164 5/20 0.60
▸ MEN1 O00255 4/20 0.60
▸ CASP3 P42574 1/20 0.57
▸ SENP8 Q96LD8 1/20 0.57
▸ SENP7 Q9BQF6 1/20 0.57
▸ SENP6 Q9GZR1 1/20 0.57
▸ CES2 O00748 1/20 0.50
▸ CES1 P23141 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.48
▸ LMNA P02545 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ CA2 P00918 1/20 0.48
▸ PARP1 P09874 1/20 0.48
▸ PRSS1 P07477 1/20 0.46

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
SCHEMBL4990373 0.89 KMT2A (0.49) ESR1ESR2KMT2AMEN1CASP3
SCHEMBL4598444 0.84 KMT2A (0.47) KMT2AMEN1ALDH1A1MAPTTDP1
SCHEMBL31124079 0.84 KMT2A (0.47) KMT2AMEN1ALDH1A1MAPTTDP1
SCHEMBL31124167 0.84 KMT2A (0.47) KMT2AMEN1ALDH1A1MAPTTDP1
SCHEMBL17914244 0.83 KMT2A (0.46) ESR1ESR2KMT2AMEN1ALDH1A1
SCHEMBL9680648 0.83 KMT2A (0.59) KMT2AMEN1ALDH1A1MAPTTDP1
SCHEMBL8968025 0.82 KMT2A (0.48) KMT2AMEN1ALDH1A1MAPTTDP1
SCHEMBL29426396 0.82 KMT2A (0.51) KMT2AMEN1ALDH1A1MAPTTDP1
SCHEMBL4204276 0.82 KMT2A (0.51) KMT2AMEN1ALDH1A1MAPTTDP1
SCHEMBL9681068 0.82 MAOA (0.60) KMT2AMEN1ALDH1A1MAPTCA2

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-5153335-A Reacting halophthalic anhydride and alkali metal salt with acid or acid derivative catalyst OCCIDENTAL CHEMICAL CORPORATION (US) 1992-10-06 — — US claimed
EP-0460687-A2 Process for the preparation of oxydiphthalic anhydride and acyloxyphthalic anhydrides OCCIDENTAL CHEMICAL CORPORATION (US) 1991-12-11 — — EP claimed
Send feedback