SCHEMBL10366190

SCHEMBL10366190

COc1ccc2c(c1)C1=NN(c3ccc(Cl)cc3)C(=O)CC1CC2

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 2/20 0.43
DRD4 P21917 2/20 0.43
AMY1A P0DUB6 3/20 0.41
ALDH1A1 P00352 4/20 0.40
MAPT P10636 3/20 0.40
GAA P10253 2/20 0.40
KDM4E B2RXH2 2/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CYP19A1 P11511 1/20 0.39
GRM5 P41594 1/20 0.38
HTT P42858 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ACHE P22303 1/20 0.38
APP P05067 1/20 0.37

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
SCHEMBL10365961 0.94 APP (0.43) ALDH1A1MAPTGAAKDM4ELMNA
SCHEMBL10367982 0.92 MEN1 (0.48) ALDH1A1MAPTGAAKDM4ELMNA
SCHEMBL10368102 0.91 KDM4E (0.48) ALDH1A1MAPTGAAKDM4ELMNA
SCHEMBL10365856 0.87 APP (0.44) ALDH1A1MAPTGAAKDM4ELMNA
SCHEMBL10367467 0.87 MAPT (0.44) AMY1AALDH1A1MAPTGAAKDM4E
SCHEMBL10658164 0.86 APP (0.40) ALDH1A1MAPTGAAKDM4EMEN1
SCHEMBL10368164 0.86 PDE4A (0.43) AMY1AALDH1A1MAPTKDM4ELMNA
SCHEMBL10365420 0.85 MAPT (0.41) ALDH1A1MAPTGAAKDM4ELMNA
SCHEMBL10365659 0.84 GRM5 (0.38) DRD2DRD4AMY1AALDH1A1MAPT
SCHEMBL10366166 0.83 MEN1 (0.43) DRD2ALDH1A1MAPTGAAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0190367-B1 BENZO ADH BDCINNOLINE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND MECIDINAL COMPOSITION CONTAINING THEM Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1990-01-17 EP claimed
EP-0190367-A1 BENZO ADh BDCINNOLINE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND MECIDINAL COMPOSITION CONTAINING THEM Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1986-08-13 EP claimed
EP-0190367-B1 BENZO ADH BDCINNOLINE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND MECIDINAL COMPOSITION CONTAINING THEM Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1990-01-17 EP disclosed
US-4782057-A ANTIDOTES FOR OVERSEDATION, ANXIOLYTICS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1988-11-01 US disclosed
EP-0190367-A1 BENZO ADh BDCINNOLINE COMPOUNDS, PROCESS FOR THEIR PREPARATION, AND MECIDINAL COMPOSITION CONTAINING THEM Yoshitomi Pharmaceutical Industries, Ltd. (JP) 1986-08-13 EP disclosed