SCHEMBL11249099

SCHEMBL11249099

CCOC(=O)Oc1cc2occ(C(=O)NC(C(=O)O)c3ccc(OC(=O)C(N)c4ccc(O)cc4)cc3)c(=O)c2cc1OC(=O)OCC

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ MAPT P10636 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ MAOB P27338 7/20 0.39
▸ ALDH2 P05091 10/20 0.39
▸ CRHBP P24387 1/20 0.38
▸ CRHR2 Q13324 1/20 0.38
▸ MAOA P21397 2/20 0.35
▸ KLK7 P49862 1/20 0.35

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
SCHEMBL11281619 0.92 MAOB (0.42) KDM4EKMT2AMAPTMEN1LMNA
Phenylglycine SCHEMBL11247409 0.87 KMT2A (0.40) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL11287124 0.85 MAOB (0.43) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL11247457 0.81 MAOB (0.39) KMT2AMAOBALDH2MAOA
SCHEMBL8311797 0.74 MAOB (0.49) MAOBMAOA
SCHEMBL11360922 0.73 MAOB (0.43) KDM4EKMT2AMAPTMEN1MAOB
SCHEMBL11123151 0.71 PTGS1 (0.50) KMT2AMAPTMEN1LMNA
SCHEMBL10961841 0.71 KMT2A (0.48) KDM4EKMT2AMAPTMEN1LMNA
SCHEMBL11153948 0.70 NR1I2 (0.41) KDM4EKMT2AMAPTMEN1MAOB
SCHEMBL8122069 0.70 MAOB (0.48) MAOBMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0054578-A1 N-(substituted chromone-3-carbonyl)-phenylglycine derivatives Eisai Co., Ltd. (JP) 1982-06-30 — — EP disclosed
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