SCHEMBL8434205

SCHEMBL8434205

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

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.69
ALDH1A1 P00352 1/20 0.63
MAPT P10636 1/20 0.63
HTT P42858 1/20 0.63
TDP1 Q9NUW8 1/20 0.62
ABCB1 P08183 13/20 0.56
DRD4 P21917 1/20 0.54
HTR7 P34969 1/20 0.53

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
SCHEMBL8430992 0.89 ABCB1 (0.62) ABCB1HTR7
SCHEMBL8434186 0.88 LMNA (0.75) LMNAALDH1A1MAPTHTTTDP1
SCHEMBL8430999 0.88 ABCB1 (0.61) MAPTABCB1HTR7
Hydrochloric Acid SCHEMBL9005295 0.87 LMNA (0.74) LMNAALDH1A1MAPTHTTTDP1
SCHEMBL8433505 0.85 POLB (0.63) MAPTABCB1HTR7
SCHEMBL8432645 0.81 MAPT (0.65) LMNAALDH1A1MAPTABCB1
SCHEMBL8431138 0.78 MAPT (0.69) LMNAALDH1A1MAPTHTTTDP1
SCHEMBL8431150 0.77 TP53 (0.63) LMNAMAPTABCB1
SCHEMBL9866432 0.76 TDP1 (0.70) LMNAALDH1A1MAPTHTTTDP1
SCHEMBL9865013 0.76 TDP1 (0.70) LMNAALDH1A1MAPTHTTTDP1

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 2 patents. 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
EP-0735030-A1 Piperazine derivative having antiallergic activity Senju Pharmaceutical Co., Ltd. (JP) 1996-10-02 EP disclosed