SCHEMBL7310334

SCHEMBL7310334

CN(Cc1ccccc1)C(=O)CC(Cc1cccc2ccccc12)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ METAP2 P50579 1/20 0.47
▸ HRH4 Q9H3N8 1/20 0.46
▸ KMT2A Q03164 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ TSPO P30536 1/20 0.45
▸ CTNNB1 P35222 1/20 0.45
▸ HPGD P15428 1/20 0.43
▸ CDK4 P11802 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ CYP1A2 P05177 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ MMP9 P14780 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ CTSG P08311 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
SCHEMBL7272298 1.00 NPC1 (0.48) NPC1RAB9AMETAP2HRH4KMT2A
SCHEMBL10756689 0.86 CTNNB1 (0.50) METAP2HRH4CTNNB1TDP1CYP1A2
SCHEMBL10477863 0.85 CTNNB1 (0.45) METAP2HRH4KMT2AMEN1CTNNB1
SCHEMBL7275603 0.83 HRH4 (0.45) METAP2HRH4KMT2ACTNNB1CYP1A2
SCHEMBL7274920 0.83 CPA1 (0.60) NPC1RAB9AKMT2AHPGDTDP1
SCHEMBL10477711 0.82 MMP9 (0.42) HRH4KMT2AMEN1CTNNB1TDP1
SCHEMBL7290086 0.81 TSHR (0.48) HRH4KMT2AMEN1CTNNB1TDP1
SCHEMBL10477663 0.81 CYP1A2 (0.41) HRH4KMT2AMEN1CTNNB1TDP1
SCHEMBL7429100 0.79 CPA1 (0.57) HRH4CTNNB1HPGDTDP1CYP1A2
SCHEMBL7352579 0.79 CYP1A2 (0.65) HRH4KMT2AMEN1CTNNB1TDP1

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-0274259-A2 New renin-inhibitory oligopeptides, their preparaton and their use Sankyo Company Limited (JP) 1988-07-13 — — EP disclosed
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