SCHEMBL9601960

SCHEMBL9601960

CC(COc1ccc(N2N=C3c4cc(Cl)ccc4CCC3CC2=O)cc1)CN(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 4/20 0.34
SIGMAR1 Q99720 4/20 0.33
CDK2 P24941 3/20 0.33
ACHE P22303 1/20 0.32
USP2 O75604 1/20 0.31
S1PR1 P21453 2/20 0.31
S1PR3 Q99500 2/20 0.31
DAPK3 O43293 1/20 0.31
JAK2 O60674 1/20 0.31
PRKD3 O94806 1/20 0.31
MAP4K4 O95819 1/20 0.31
PAK4 O96013 1/20 0.31
ABL1 P00519 1/20 0.31
LCK P06239 1/20 0.31
FYN P06241 1/20 0.31
CSF1R P07333 1/20 0.31
IGF1R P08069 1/20 0.31
PDGFRB P09619 1/20 0.31
FGFR1 P11362 1/20 0.31
PDGFRA P16234 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
SCHEMBL9865917 0.90 MAOA (0.34) CDK4ACHES1PR1S1PR3
Hydrochloric Acid SCHEMBL9602310 0.89 S1PR1 (0.33) CDK4CDK2ACHES1PR1S1PR3
SCHEMBL9603147 0.88 MCHR1 (0.35) SIGMAR1ACHEPTH1RMCHR1
SCHEMBL9866182 0.88 ACHE (0.33) ACHES1PR1S1PR3
SCHEMBL9603188 0.88 MAPT (0.37) SIGMAR1ACHE
Fumaric Acid SCHEMBL9602985 0.84 MAPT (0.33) S1PR1S1PR3
Fumaric Acid SCHEMBL9602984 0.84 MAPT (0.33) S1PR1S1PR3
SCHEMBL9602137 0.82 S1PR1 (0.32) ACHEUSP2S1PR1S1PR3
SCHEMBL9603020 0.82 MAPT (0.39) MCHR1
SCHEMBL10365420 0.80 MAPT (0.41)

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