SCHEMBL7947657

SCHEMBL7947657

Cc1ccnc(N2CCC(Oc3ccccc3OCc3ccccc3)CC2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.47
HTR2B P41595 1/20 0.47
CHRM4 P08173 1/20 0.45
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
GRIN2D O15399 1/20 0.42
GRIN3B O60391 1/20 0.42
GRIN1 Q05586 1/20 0.42
GRIN2A Q12879 1/20 0.42
GRIN2B Q13224 1/20 0.42
GRIN2C Q14957 1/20 0.42
GRIN3A Q8TCU5 1/20 0.42
OGA O60502 1/20 0.41
CPT2 P23786 1/20 0.41
CPT1A P50416 1/20 0.41
CPT1B Q92523 1/20 0.41

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
SCHEMBL7961307 0.78 F10 (0.52) HTR2CHTR2BHTR1AADRA2AADRA2B
SCHEMBL2128731 0.74 GRIN2D (0.48) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL26348587 0.73 ACHE (0.56) CHRM4ALDH1A1LMNAGRIN2DGRIN3B
SCHEMBL15592458 0.70 GRM5 (0.54) HTR2CHTR2BKDM4EALDH1A1LMNA
SCHEMBL15337848 0.69 GRIN2D (0.51) CHRM4KDM4EALDH1A1TSHRHTT
SCHEMBL2129556 0.69 PIK3CD (0.48) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL18949715 0.68 GRIN2D (0.60) KDM4EALDH1A1LMNATSHRHTT
SCHEMBL2130656 0.68 GRIN2D (0.50) CHRM4KDM4EHTTGRIN2DGRIN3B
SCHEMBL2636637 0.68 SMN1; SMN2 (0.46) HTR2CHTR2BALDH1A1
SCHEMBL2636638 0.68 SMN1; SMN2 (0.47) HTR2CHTR2BALDH1A1LMNA

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-6313127-B1 FOR THERAPY OF HYPERCHOLESTEROLEMIA OR ATHEROSCLEROSIS ZENECA LIMITED (GB) 2001-11-06 US disclosed