SCHEMBL9872089

SCHEMBL9872089

CCCCCCNCCC(N)c1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.46
CHRM2 P08172 1/20 0.44
DRD2 P14416 1/20 0.41
DRD4 P21917 1/20 0.41
DRD3 P35462 1/20 0.41
SLC6A3 Q01959 1/20 0.41
TSHR P16473 2/20 0.40
ALDH1A1 P00352 1/20 0.39
SIGMAR1 Q99720 1/20 0.38
SCN5A Q14524 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KCNH3 Q9ULD8 1/20 0.38
MITF O75030 1/20 0.36
LMNA P02545 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
GPR35 Q9HC97 1/20 0.36
GPR55 Q9Y2T6 1/20 0.36

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
SCHEMBL9871251 1.00 SLC2A1 (0.46) SLC2A1CHRM2DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL9872603 0.98 SLC2A1 (0.48) SLC2A1CHRM2DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL9870909 0.98 SLC2A1 (0.48) SLC2A1CHRM2DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL9872736 0.98 SLC2A1 (0.48) SLC2A1CHRM2DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL9872787 0.98 SLC2A1 (0.48) SLC2A1CHRM2DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL9872391 0.98 SLC2A1 (0.48) SLC2A1CHRM2DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL9872771 0.98 SLC2A1 (0.48) SLC2A1CHRM2DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL9873085 0.98 SLC2A1 (0.48) SLC2A1CHRM2DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL9872912 0.98 SLC2A1 (0.48) SLC2A1CHRM2DRD2DRD4DRD3
Hydrochloric Acid SCHEMBL9872836 0.98 SLC2A1 (0.48) SLC2A1CHRM2DRD2DRD4DRD3

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-5039706-A Antiinflammatory, antiallergenic agent DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1991-08-13 US claimed