SCHEMBL1286845

SCHEMBL1286845

O=C(NC1CC12CCN(c1ccc(Cl)cc1)CC2)c1cccc2ccccc12

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 4/20 0.66
▸ DRD4 P21917 7/20 0.52
▸ KMT2A Q03164 1/20 0.45
▸ MITF O75030 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ MMP3 P08254 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ POLB P06746 1/20 0.41

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
SCHEMBL1709219 0.91 SCN9A (0.74) SCN9ADRD4KMT2AMITFALDH1A1
SCHEMBL10072166 0.87 SCN9A (0.60) SCN9ADRD4KMT2AMITFALDH1A1
SCHEMBL10072037 0.87 SCN9A (0.62) SCN9ADRD4KMT2AMITFALDH1A1
SCHEMBL10072167 0.86 SCN9A (0.61) SCN9ADRD4KMT2AMITFALDH1A1
SCHEMBL1709222 0.82 SCN9A (0.60) SCN9ADRD4KMT2AALDH1A1MMP3
SCHEMBL10072036 0.82 SCN9A (0.55) SCN9ADRD4KMT2AALDH1A1MMP3
SCHEMBL10072168 0.82 SCN9A (0.56) SCN9ADRD4KMT2AALDH1A1MMP3
SCHEMBL1709220 0.81 SCN9A (0.55) SCN9ADRD4KMT2AMITF
SCHEMBL1709255 0.80 SCN9A (0.57) SCN9AKMT2AALDH1A1LMNAPOLB
SCHEMBL10071958 0.80 DRD4 (0.67) SCN9ADRD4

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
WO-2012047703-A2 CYCLOPROPYL-SPIRO-PIPERIDINES USEFUL AS SODIUM CHANNEL BLOCKERS SCHERING CORPORATION (US) 2012-04-12 — — WO disclosed
WO-2012047703-A2 CYCLOPROPYL-SPIRO-PIPERIDINES USEFUL AS SODIUM CHANNEL BLOCKERS SCHERING CORPORATION (US) 2012-04-12 — — WO disclosed
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