SCHEMBL4606621

SCHEMBL4606621

N[C@@H](Cc1c[nH]c2ccccc12)C(=O)C1=CC(=O)C=CC1=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.61
▸ MAPT P10636 2/20 0.61
▸ MEN1 O00255 1/20 0.61
▸ LMNA P02545 1/20 0.61
▸ MPO P05164 1/20 0.61
▸ TSHR P16473 1/20 0.61
▸ BLM P54132 1/20 0.61
▸ PMP22 Q01453 1/20 0.61
▸ KMT2A Q03164 1/20 0.61
▸ HIF1A Q16665 1/20 0.61
▸ DNMT1 P26358 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ HTR2A P28223 2/20 0.49
▸ ADRB1 P08588 1/20 0.49
▸ HTR1A P08908 1/20 0.49
▸ ADRA2A P08913 1/20 0.49
▸ SLC6A2 P23975 1/20 0.49
▸ HTR1D P28221 1/20 0.49
▸ HTR1B P28222 1/20 0.49
▸ HTR2C P28335 1/20 0.49

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
SCHEMBL4606618 1.00 KDM4E (0.61) KDM4EMAPTMEN1LMNAMPO
Dl-Tryptophan SCHEMBL733703 0.96 KMT2A (0.70) KDM4EMAPTMEN1LMNAMPO
Cysteine SCHEMBL19971581 0.92 KDM4E (0.61) KDM4EMAPTMEN1LMNAMPO
Tryptophan SCHEMBL28531880 0.81 KMT2A (0.86) KDM4EMAPTMEN1LMNAMPO
SCHEMBL31373413 0.78 MAPT (0.76) KDM4EMAPTMEN1LMNAMPO
Tryptophan SCHEMBL1839783 0.78 KMT2A (0.80) KDM4EMAPTMEN1LMNAMPO
Dl-Tryptophan SCHEMBL1839782 0.78 KMT2A (0.80) KDM4EMAPTMEN1LMNAMPO
Dl-Tryptophan SCHEMBL28267454 0.78 KMT2A (0.97) KDM4EMAPTMEN1LMNAMPO
Tryptophan SCHEMBL11064226 0.78 KMT2A (0.97) KDM4EMAPTMEN1LMNAMPO
Tryptophan SCHEMBL23141133 0.76 KMT2A (1.00) KDM4EMAPTMEN1LMNAMPO

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
EP-1068339-B1 COMPOSITIONS AND METHODS FOR PROTEIN SECRETION UNIV ALBERTA (CA) 2008-07-23 — — EP claimed
EP-1068339-B1 COMPOSITIONS AND METHODS FOR PROTEIN SECRETION UNIV ALBERTA (CA) 2008-07-23 — — EP disclosed
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