SCHEMBL6992387

SCHEMBL6992387

CCCCCN1CCC(CCOc2cccc(OC(C)C)c2)C(OCCOC)C1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
HRH3 Q9Y5N1 12/20 0.40
ALDH1A1 P00352 4/20 0.39
TSHR P16473 2/20 0.39
KDM4E B2RXH2 3/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL6992384 1.00 MEN1 (0.40) MEN1KMT2AHRH3ALDH1A1TSHR
Oxalic Acid SCHEMBL6997385 0.96 KMT2A (0.47) MEN1KMT2AHRH3ALDH1A1KDM4E
Oxalic Acid SCHEMBL6997388 0.96 KMT2A (0.47) MEN1KMT2AHRH3ALDH1A1KDM4E
Oxalic Acid SCHEMBL6998748 0.88 KMT2A (0.49) MEN1KMT2AHRH3ALDH1A1KDM4E
Oxalic Acid SCHEMBL7001732 0.88 KMT2A (0.49) MEN1KMT2AHRH3ALDH1A1KDM4E
SCHEMBL6997176 0.82 KDM4E (0.47) MEN1KMT2AHRH3ALDH1A1TSHR
SCHEMBL6999792 0.82 KDM4E (0.47) MEN1KMT2AHRH3ALDH1A1TSHR
Oxalic Acid SCHEMBL6996239 0.80 KDM4E (0.51) MEN1KMT2AHRH3ALDH1A1KDM4E
Oxalic Acid SCHEMBL6991315 0.80 KDM4E (0.51) MEN1KMT2AHRH3ALDH1A1KDM4E
Oxalic Acid SCHEMBL6996106 0.79 HRH3 (0.57) MEN1KMT2AHRH3ALDH1A1KDM4E

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0853615-B1 PIPERIDINE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS NEUROSEARCH AS (DK) 2003-12-10 EP claimed
EP-0853615-A1 PIPERIDINE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS NEUROSEARCH A/S (DK) 1998-07-22 EP claimed
WO-1997010212-A1 PIPERIDINE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS NEUROSEARCH A/S (DK) 1997-03-20 WO claimed
EP-0853615-B1 PIPERIDINE COMPOUNDS AS CALCIUM CHANNEL BLOCKERS NEUROSEARCH AS (DK) 2003-12-10 EP disclosed