SCHEMBL9603020

SCHEMBL9603020

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

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
LMNA P02545 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
ATF4 P18848 1/20 0.34
FFAR1 O14842 1/20 0.34
HPGD P15428 1/20 0.34
BRD4 O60885 1/20 0.34
MCHR1 Q99705 2/20 0.34

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
SCHEMBL9601493 0.89 MAPT (0.40) MAPTMEN1KMT2ALMNAKDM4E
SCHEMBL10368047 0.84 POLB (0.44) MAPTMEN1KMT2ALMNANPC1
SCHEMBL10365420 0.83 MAPT (0.41) MAPTMEN1KMT2ALMNATDP1
SCHEMBL9601978 0.82 MEN1 (0.35) MAPTMEN1KMT2ALMNATDP1
SCHEMBL9601960 0.82 CDK4 (0.34) MCHR1
SCHEMBL10366190 0.82 DRD2 (0.43) MAPTMEN1KMT2ALMNATDP1
Fumaric Acid SCHEMBL9602985 0.81 MAPT (0.33) MAPTMEN1KMT2ALMNATDP1
Fumaric Acid SCHEMBL9602984 0.81 MAPT (0.33) MAPTMEN1KMT2ALMNATDP1
SCHEMBL10367909 0.81 GRM5 (0.36) MAPTMEN1KMT2ALMNATDP1
SCHEMBL10367469 0.81 MAPT (0.38) MAPTMEN1KMT2ALMNATDP1

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