SCHEMBL7004573

SCHEMBL7004573

COc1ccc2c(n1)c(CCNC(=O)Oc1ccco1)c1n2C(=O)c2ccccc2-1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MTNR1A P48039 16/20 0.40
▸ MTNR1B P49286 16/20 0.40
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ TACR1 P25103 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL5367177 0.86 SMN1; SMN2 (0.46) MTNR1AMTNR1BALDH1A1LMNA
SCHEMBL6997653 0.83 MTNR1A (0.49) MTNR1AMTNR1BKDM4EALDH1A1HPGD
SCHEMBL7000349 0.80 MTNR1A (0.51) MTNR1AMTNR1BKDM4EALDH1A1LMNA
SCHEMBL6995494 0.77 MTNR1A (0.39) MTNR1AMTNR1B
SCHEMBL7000833 0.76 MTNR1A (0.38) MTNR1AMTNR1B
SCHEMBL5368761 0.75 TACR1 (0.36) MTNR1AMTNR1BKDM4EALDH1A1LMNA
SCHEMBL5368769 0.69 MTNR1A (0.50) MTNR1AMTNR1BKDM4EALDH1A1HPGD
SCHEMBL7000227 0.69 MTNR1A (0.49) MTNR1AMTNR1BKDM4EALDH1A1LMNA
SCHEMBL5364390 0.68 MTNR1A (0.51) MTNR1AMTNR1BKDM4EALDH1A1LMNA
SCHEMBL5367185 0.67 MTNR1A (0.53) MTNR1AMTNR1BKDM4EALDH1A1LMNA

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-1092717-B1 Polycyclic azaindole derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2003-01-08 — — EP claimed
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