SCHEMBL6796583

SCHEMBL6796583

NC(=O)C(=O)N1CC2CN(Cc3cc(F)cc(F)c3)CC2C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 1/20 0.39
MAOB P27338 1/20 0.39
MAP4K4 O95819 2/20 0.38
GRIN2B Q13224 2/20 0.38
GPR183 P32249 1/20 0.38
DPP4 P27487 1/20 0.38
DPP8 Q6V1X1 1/20 0.38
FAAH O00519 2/20 0.35
CHRNA4 P43681 2/20 0.35
CHRNB2 P17787 1/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
DRD2 P14416 1/20 0.35
DRD4 P21917 1/20 0.35
EPHX1 P07099 1/20 0.35
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL6796586 0.83 HDAC1 (0.46) SIGMAR1MAOBMAP4K4GRIN2BGPR183
SCHEMBL1012603 0.73 HDAC3 (0.56) MAOBMAP4K4GRIN2BCYP2D6HDAC3
SCHEMBL6797003 0.73 GRIN2B (0.38) SIGMAR1GRIN2BGPR183DRD2DRD4
SCHEMBL6363840 0.70 GRIN2B (0.45) GRIN2B
SCHEMBL17896857 0.69 MAOB (0.52) MAOBMAP4K4
SCHEMBL15587429 0.69 MAOB (0.52) MAOBMAP4K4
SCHEMBL8242862 0.66 HDAC3 (0.76) CYP2D6CYP2C19HDAC3HDAC4HDAC1
SCHEMBL3081900 0.66 GPR183 (0.54) SIGMAR1GPR183FAAHCYP2D6CYP2C9
SCHEMBL17896327 0.66 MAOB (0.49) MAOBMAP4K4
SCHEMBL13649146 0.66 GRIN2B (0.55) SIGMAR1GRIN2B

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-6821964-B2 FOR PROPHYLAXIS AND THERAPY OF DISEASES ASSOCIATED WITH MONOCYTE ACCUMULATION, LYMPHOCYTE ACCUMULATION OR LEUCOCYTE ACCUMULATION PFIZER INC 2004-11-23 US disclosed