SCHEMBL9602191

SCHEMBL9602191

CC(COc1cccc(N2N=C3c4cc(F)ccc4CCC3CC2=O)c1)N(C)C

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.32
TOP1 P11387 1/20 0.32
MAPT P10636 3/20 0.32
KDM4E B2RXH2 2/20 0.32
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
MAOB P27338 1/20 0.31
HCRTR1 O43613 1/20 0.31
HCRTR2 O43614 1/20 0.31

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
SCHEMBL9602515 0.92 ALDH1A1 (0.33) DRD2TOP1MAPTKDM4EALDH1A1
SCHEMBL9602137 0.90 S1PR1 (0.32) DRD2MAPTKDM4EUSP2ALDH1A1
Fumaric Acid SCHEMBL9603164 0.86 KDM4E (0.35) DRD2MAPTKDM4EALDH1A1LMNA
Fumaric Acid SCHEMBL9603160 0.86 KDM4E (0.35) DRD2MAPTKDM4EALDH1A1LMNA
SCHEMBL9605374 0.86 XIAP (0.33) DRD2KDM4EALDH1A1
SCHEMBL9601994 0.86 ACHE (0.40) DRD2KDM4EALDH1A1
Fumaric Acid SCHEMBL9866670 0.85 LMNA (0.34) DRD2MAPTKDM4EALDH1A1LMNA
Fumaric Acid SCHEMBL9866661 0.85 LMNA (0.34) DRD2MAPTKDM4EALDH1A1LMNA
SCHEMBL9867304 0.84 MAOA (0.35) TOP1GAAMAOB
Fumaric Acid SCHEMBL9603157 0.84 LMNA (0.34) DRD2MAPTKDM4EALDH1A1LMNA

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