SCHEMBL11073097

SCHEMBL11073097

CCCCn1c(CCN2CCN(c3ccccc3)CC2)nc2cc(Br)c3ccccc3c21

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HSD17B10 Q99714 1/20 0.47
HTR1A P08908 7/20 0.47
HTR7 P34969 6/20 0.47
DRD3 P35462 2/20 0.46
HTR2A P28223 1/20 0.44
DRD2 P14416 2/20 0.43
SIGMAR1 Q99720 1/20 0.43
PARP1 P09874 1/20 0.43
DRD4 P21917 1/20 0.43
KCNH2 Q12809 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
SCHEMBL11065358 0.85 TSHR (0.49) ALDH1A1LMNATSHRHTTSMN1; SMN2
SCHEMBL11073093 0.83 ALDH1A1 (0.46) ALDH1A1LMNATSHRHTTSMN1; SMN2
SCHEMBL11070029 0.82 HTR1A (0.48) ALDH1A1LMNATSHRHTTSMN1; SMN2
SCHEMBL11063723 0.82 PARP1 (0.42) HTR1AHTR7DRD3DRD2SIGMAR1
SCHEMBL11065960 0.80 PDE4A (0.41) LMNATSHRHTTSMN1; SMN2
SCHEMBL11093364 0.77 KCNH2 (0.51) LMNASMN1; SMN2HTR1AHTR7DRD3
SCHEMBL11066354 0.74 ALDH1A1 (0.42) ALDH1A1LMNAHTTSMN1; SMN2HSD17B10
SCHEMBL11065847 0.74 SIGMAR1 (0.54) ALDH1A1TSHRSMN1; SMN2HTR1AHTR7
SCHEMBL11066133 0.73 KCNH2 (0.49) HTR1AHTR7DRD3HTR2ADRD2
SCHEMBL155128 0.73 SIGMAR1 (0.79) HTR1ADRD3HTR2ADRD2SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0034249-B1 NEW NAPHTHIMIDAZOLE AND NAPHTHOXAZOLE DERIVATIVES, THEIR PREPARATION, AND THEIR USE IN PHARMACEUTICALS GRUPPO LEPETIT S.P.A. (IT) 1984-10-24 EP disclosed
US-4461894-A Naphth[1,2-d]imidazoles GRUPPO LEPETIT S.P.A. (IT) 1984-07-24 US disclosed
US-4360674-A Naphth[1,2-d]imidazoles GRUPPO LEPETIT S.P.A. (IT) 1982-11-23 US disclosed
EP-0034249-A2 New naphthimidazole and naphthoxazole derivatives, their preparation, and their use in pharmaceuticals GRUPPO LEPETIT S.P.A. (IT) 1981-08-26 EP disclosed