SCHEMBL14559554

SCHEMBL14559554

CCNC(=O)NCC(c1ccccc1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 1/20 0.49
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ MTNR1A P48039 2/20 0.47
▸ MTNR1B P49286 2/20 0.47
▸ LMNA P02545 2/20 0.46
▸ TACR1 P25103 2/20 0.45
▸ CASR P41180 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ BCAT2 O15382 1/20 0.43
▸ SLC1A2 P43004 1/20 0.42
▸ SLC1A1 P43005 1/20 0.42
▸ P2RX7 Q99572 1/20 0.42
▸ EPHX2 P34913 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ CNR1 P21554 1/20 0.42
▸ CNR2 P34972 1/20 0.42

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
SCHEMBL13647161 0.83 MTNR1A (0.49) MTNR1AMTNR1BLMNATACR1CASR
SCHEMBL2091812 0.79 MTNR1A (0.67) MTNR1AMTNR1BLMNATACR1BCAT2
SCHEMBL2726717 0.78 LMNA (0.53) MTNR1AMTNR1BLMNATACR1BCAT2
SCHEMBL13480537 0.78 NPSR1 (0.58) PKMMEN1KMT2ALMNACASR
SCHEMBL8005868 0.77 POLB (0.60) PKMMEN1KMT2ALMNACASR
SCHEMBL9504011 0.77 HTT (0.52) —
SCHEMBL10154589 0.76 CASR (0.69) MEN1KMT2ALMNACASRPOLB
SCHEMBL12000489 0.76 KMT2A (0.53) MEN1KMT2AMTNR1AMTNR1BLMNA
SCHEMBL8923076 0.75 EPHX2 (0.67) LMNAEPHX2
SCHEMBL753128 0.75 NAALAD2 (0.59) PKMMEN1KMT2ACASR

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-7186725-B2 Anti-inflammatory compositions and methods GENZYME CORPORATION (US) 2007-03-06 — — US disclosed
US-7186725-B2 Anti-inflammatory compositions and methods GENZYME CORPORATION (US) 2007-03-06 — — US disclosed
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