SCHEMBL7898064

SCHEMBL7898064

c1cnc2c(c1)CC(C1CCCN1)C2

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CHRNB2 P17787 3/20 0.37
▸ CHRNA4 P43681 3/20 0.37
▸ CHRNA7 P36544 1/20 0.36
▸ CYP2D6 P10635 4/20 0.36
▸ DRD2 P14416 1/20 0.36
▸ DRD3 P35462 1/20 0.36
▸ MBTD1 Q05BQ5 1/20 0.35
▸ L3MBTL3 Q96JM7 1/20 0.35
▸ CHRNB4 P30926 1/20 0.35
▸ CHRNA3 P32297 1/20 0.35

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
SCHEMBL26725468 0.80 MBTD1 (0.42) MBTD1L3MBTL3
SCHEMBL20833280 0.80 MBTD1 (0.42) MBTD1L3MBTL3
SCHEMBL7900993 0.75 MBTD1 (0.35) CHRNB2CHRNA4MBTD1L3MBTL3CHRNA3
SCHEMBL24399967 0.75 DRD2 (0.41) CYP2D6DRD2DRD3
SCHEMBL7899298 0.74 MBTD1 (0.34) MBTD1L3MBTL3CHRNA3
SCHEMBL7899195 0.72 DPP4 (0.43) —
SCHEMBL7899197 0.72 DPP4 (0.43) —
SCHEMBL7899159 0.71 DRD2 (0.41) CYP2D6DRD2DRD3MBTD1L3MBTL3
SCHEMBL8186354 0.71 CHRNB2 (0.38) CHRNB2CHRNA4CHRNB4CHRNA3
Hydrochloric Acid SCHEMBL8186570 0.70 CHRNB2 (0.37) CHRNB2CHRNA4CHRNB4CHRNA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6184229-B1 6-pyrrolidin-2-ylpyrindine derivatives, their preparation and application in therapy SANOFI-SYNTHELABO (FR) 2001-02-06 — — US disclosed
EP-1000056-A1 6-PYRROLIDIN-2-YLPYRINDINE DERIVATIVES, THEIR PREPARATION AND APPLICATION IN THERAPY SANOFI-SYNTHELABO (FR) 2000-05-17 — — EP disclosed
WO-1999002517-A1 6-PYRROLIDIN-2-YLPYRINDINE DERIVATIVES, THEIR PREPARATION AND APPLICATION IN THERAPY SANOFI-SYNTHELABO (FR) 1999-01-21 — — WO disclosed
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