SCHEMBL7900993

SCHEMBL7900993

Clc1ccc2c(n1)CC(C1CCCN1)C2

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MBTD1 Q05BQ5 1/20 0.35
▸ L3MBTL3 Q96JM7 1/20 0.35
▸ CHRNA3 P32297 2/20 0.33
▸ HTR2A P28223 1/20 0.33
▸ HTR2C P28335 1/20 0.33
▸ HTR2B P41595 1/20 0.33
▸ OPRM1 P35372 1/20 0.32
▸ OPRL1 P41146 1/20 0.32
▸ CHRNB2 P17787 1/20 0.32
▸ CHRNA4 P43681 1/20 0.32

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
SCHEMBL7899159 0.79 DRD2 (0.41) MBTD1L3MBTL3HTR2AHTR2CHTR2B
SCHEMBL7898064 0.75 CHRNB2 (0.37) MBTD1L3MBTL3CHRNA3CHRNB2CHRNA4
SCHEMBL20833280 0.72 MBTD1 (0.42) MBTD1L3MBTL3OPRM1OPRL1
SCHEMBL26725468 0.72 MBTD1 (0.42) MBTD1L3MBTL3OPRM1OPRL1
SCHEMBL7899298 0.70 MBTD1 (0.34) MBTD1L3MBTL3CHRNA3HTR2AHTR2C
SCHEMBL13998647 0.65 HTR2A (0.40) HTR2AHTR2CHTR2BCHRNB2CHRNA4
SCHEMBL12669982 0.65 CHRNB2 (0.36) HTR2AHTR2CHTR2BCHRNB2CHRNA4
SCHEMBL27981835 0.63 PNMT (0.51) —
SCHEMBL31621633 0.62 P2RX7 (0.36) CHRNB2CHRNA4
SCHEMBL12891917 0.62 DRD2 (0.39) HTR2AHTR2CHTR2BCHRNB2CHRNA4

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
US-6184229-B1 6-pyrrolidin-2-ylpyrindine derivatives, their preparation and application in therapy SANOFI-SYNTHELABO (FR) 2001-02-06 — — US disclosed
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