SCHEMBL9602428

SCHEMBL9602428

CC(COc1ccc(-n2nc3c(cc2=O)CCc2ccc(F)cc2-3)cc1)N1CCN(C)CC1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.41
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
DRD2 P14416 2/20 0.35
DRD3 P35462 1/20 0.34
SRC P12931 1/20 0.34
MCHR1 Q99705 2/20 0.33
MC4R P32245 1/20 0.32

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
SCHEMBL9602165 0.93 HRH3 (0.41) HRH3ALDH1A1GAAKMT2ADRD2
SCHEMBL9602911 0.91 HRH3 (0.38) HRH3ALDH1A1GAAKMT2ADRD2
SCHEMBL9602470 0.87 KDM4E (0.51) ALDH1A1KMT2ADRD2
SCHEMBL9602093 0.84 HRH3 (0.39) HRH3ALDH1A1GAAKMT2ADRD2
SCHEMBL9601997 0.84 HRH3 (0.39) HRH3ALDH1A1GAAKMT2ADRD2
SCHEMBL9601550 0.84 HRH3 (0.40) HRH3ALDH1A1GAAKMT2ADRD2
SCHEMBL9873107 0.83 HRH3 (0.38) HRH3ALDH1A1GAAKMT2ADRD2
Iodide SCHEMBL10445026 0.82 HRH3 (0.37) HRH3ALDH1A1GAAKMT2ADRD2
SCHEMBL9602367 0.81 ATM (0.47) KMT2ADRD2
SCHEMBL9867239 0.81 HRH3 (0.39) HRH3DRD2MCHR1

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-0351435-B1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1993-08-04 EP disclosed
US-5045541-A Immunodeficiency disorders YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1991-09-03 US disclosed
EP-0351435-A1 FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1990-01-24 EP disclosed