SCHEMBL9563175

SCHEMBL9563175

Nc1ccccc1OCCCN1CCC(OC(c2cccnc2)c2cccs2)CC1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PARP14 Q460N5 1/20 0.42
BCHE P06276 5/20 0.38
HPGDS O60760 1/20 0.37
TSHR P16473 1/20 0.36
HTR1A P08908 1/20 0.35
HTR7 P34969 1/20 0.35

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
SCHEMBL9563186 0.90 PARP14 (0.48) PARP14BCHEHPGDSHTR1A
SCHEMBL9563307 0.88 PARP14 (0.52) PARP14BCHEHPGDSHTR1A
SCHEMBL9563209 0.88 PARP14 (0.42) PARP14BCHEHPGDSHTR7
SCHEMBL9563171 0.86 PARP14 (0.43) PARP14BCHEHPGDSHTR1A
SCHEMBL9563329 0.86 CYP2D6 (0.46) PARP14BCHE
SCHEMBL9563200 0.85 PARP14 (0.40) PARP14BCHEHPGDSHTR1A
SCHEMBL9563256 0.84 HTR1A (0.40) PARP14BCHETSHRHTR1AHTR7
SCHEMBL9563357 0.81 PARP14 (0.55) PARP14BCHEHPGDSHTR1A
SCHEMBL9563205 0.79 PARP14 (0.58) PARP14BCHEHPGDSHTR1A
SCHEMBL9563245 0.76 PARP14 (0.51) PARP14BCHEHPGDSHTR1A

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
EP-0529365-A1 Diarylmethoxypiperidine derivatives Kaken Pharmaceutical Co., Ltd. (JP) 1993-03-03 EP disclosed
US-5190959-A Antihistamines, antiallergens, treatment of ischemic heart disease KAKEN PHARMACEUTICAL CO. LTD. (JP) 1993-03-02 US disclosed