SCHEMBL8430992

SCHEMBL8430992

CCOC(=O)c1ccccc1N1CCN(CC(O)COc2ccccc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 16/20 0.62
L3MBTL1 Q9Y468 1/20 0.58
HTR7 P34969 1/20 0.58

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
SCHEMBL8430999 0.93 ABCB1 (0.61) ABCB1HTR7
SCHEMBL8433505 0.92 POLB (0.63) ABCB1L3MBTL1HTR7
SCHEMBL8434205 0.89 LMNA (0.69) ABCB1HTR7
SCHEMBL8434695 0.87 L3MBTL1 (0.67) ABCB1L3MBTL1HTR7
SCHEMBL8432645 0.86 MAPT (0.65) ABCB1
SCHEMBL8431138 0.84 MAPT (0.69) ABCB1
SCHEMBL8434402 0.82 TP53 (0.53) ABCB1L3MBTL1
SCHEMBL8431150 0.81 TP53 (0.63) ABCB1
SCHEMBL8432590 0.81 ABCB1 (0.61) ABCB1L3MBTL1HTR7
SCHEMBL8430932 0.80 ABCB1 (0.56) ABCB1

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

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