SCHEMBL6175328

SCHEMBL6175328

CCCN1CCC(Nc2ccccc2)CC1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.72
PRMT6 Q96LA8 1/20 0.72
PABPC1 P11940 1/20 0.60
DRD2 P14416 6/20 0.58
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA4 P22748 1/20 0.54
CA5A P35218 1/20 0.54
CA7 P43166 1/20 0.54
CA9 Q16790 1/20 0.54
CA13 Q8N1Q1 1/20 0.54
CA14 Q9ULX7 1/20 0.54
SIGMAR1 Q99720 1/20 0.53
KDM4E B2RXH2 1/20 0.52
POLB P06746 1/20 0.50
ROCK2 O75116 1/20 0.50
ROCK1 Q13464 1/20 0.50
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL16256981 0.90 CARM1 (0.68) CARM1PRMT6PABPC1DRD2CA12
SCHEMBL18741437 0.86 KDM4E (0.68) CARM1PRMT6PABPC1CA12CA1
SCHEMBL27944117 0.83 CARM1 (0.68) CARM1PRMT6PABPC1DRD2CA12
SCHEMBL916913 0.82 CA12 (0.71) CARM1PRMT6DRD2CA12CA1
SCHEMBL2674960 0.80 POLB (0.68) CARM1PRMT6CA12CA1CA2
SCHEMBL11932545 0.80 CARM1 (0.63) CARM1PRMT6CA12CA1CA2
SCHEMBL2575970 0.80 CARM1 (0.59) CARM1PRMT6CA12CA1CA2
SCHEMBL4500805 0.80 PABPC1 (0.76) CARM1PRMT6PABPC1DRD2KDM4E
SCHEMBL7110809 0.80 CARM1 (0.62) CARM1PRMT6PABPC1DRD2CA12
SCHEMBL7500758 0.79 CARM1 (0.62) CARM1PRMT6

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-1049676-B1 4- ARYL(PIPERIDIN-4-YL)] AMINOBENZAMIDES WHICH BIND TO THE DELTA-OPIOID RECEPTOR ORTHO MCNEIL PHARM INC (US) 2005-10-12 EP disclosed
US-6436959-B1 DELTA-OPIOID RECEPTOR AGONISTS/ANTAGONISTS, ANALGESICS ORTHO-MCNEIL PHARMACEUTICAL, INC. 2002-08-20 US disclosed
EP-1049676-A1 4- ARYL(PIPERIDIN-4-YL)] AMINOBENZAMIDES WHICH BIND TO THE DELTA-OPIOID RECEPTOR Ortho-Mcneil Pharmaceutical, Inc. (US) 2000-11-08 EP disclosed
WO-1999033806-A1 4-[ARYL(PIPERIDIN-4-YL)] AMINOBENZAMIDES WHICH BIND TO THE DELTA-OPIOID RECEPTOR ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 1999-07-08 WO disclosed