SCHEMBL8434186

SCHEMBL8434186

O=C(O)c1ccccc1N1CCN(CC(O)COc2ccc([N+](=O)[O-])cc2)CC1

nearest known ligand 0.75

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.75
TDP1 Q9NUW8 1/20 0.71
MAPT P10636 2/20 0.63
ALDH1A1 P00352 1/20 0.63
HTT P42858 1/20 0.63
DRD4 P21917 1/20 0.61
ABCB1 P08183 9/20 0.56
HTR7 P34969 2/20 0.55
HSP90AB1 P08238 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.52

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
Hydrochloric Acid SCHEMBL9005295 0.99 LMNA (0.74) LMNATDP1MAPTALDH1A1HTT
SCHEMBL8434695 0.88 L3MBTL1 (0.67) HTTABCB1HTR7L3MBTL1
SCHEMBL8434205 0.88 LMNA (0.69) LMNATDP1MAPTALDH1A1HTT
SCHEMBL8432590 0.86 ABCB1 (0.61) LMNAMAPTABCB1HTR7L3MBTL1
SCHEMBL8432330 0.85 ABCB1 (0.60) LMNAMAPTALDH1A1ABCB1HTR7
SCHEMBL7157651 0.81 TDP1 (0.69) LMNATDP1MAPTALDH1A1HTT
SCHEMBL9866432 0.80 TDP1 (0.70) LMNATDP1MAPTALDH1A1HTT
SCHEMBL9865921 0.80 TDP1 (0.70) LMNATDP1MAPTALDH1A1HTT
SCHEMBL9865013 0.80 TDP1 (0.70) LMNATDP1MAPTALDH1A1HTT
Hydrochloric Acid SCHEMBL9865660 0.79 TDP1 (0.70) LMNATDP1MAPTALDH1A1HTT

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-5981530-A FOR TREATMENT OF ALLERGIC DISEASES SENJU PHARMACEUTICAL CO., LTD. (JP) 1999-11-09 US disclosed