SCHEMBL7682628

SCHEMBL7682628

COc1cc2c(-c3ccncc3)nn(C)c(=O)c2cc1OC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
KMT2A Q03164 1/20 0.46
LMNA P02545 1/20 0.45
HPGD P15428 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
ALDH1A1 P00352 2/20 0.44
KDM4E B2RXH2 5/20 0.43
ENPP1 P22413 3/20 0.43
HTT P42858 1/20 0.43
PKM P14618 1/20 0.43
TSHR P16473 1/20 0.43
NPSR1 Q6W5P4 3/20 0.42
PDE5A O76074 1/20 0.41
PDE4A P27815 1/20 0.41
PDE1A P54750 1/20 0.41
PDE1B Q01064 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
PDE3B Q13370 1/20 0.41

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
SCHEMBL12923926 0.84 PDE10A (0.50) MAPTKMT2AHPGDPDE5APDE4A
SCHEMBL25547865 0.81 ENPP1 (0.53) MAPTKMT2ALMNAHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL30088694 0.80 ENPP1 (0.52) MAPTKMT2ALMNAHPGDSMN1; SMN2
SCHEMBL8268002 0.77 HPGD (0.64) MAPTKMT2AHPGDSMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL31384250 0.76 ENPP1 (0.56) MAPTKMT2ALMNAHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL28917135 0.76 ENPP1 (0.53) MAPTKMT2ALMNAHPGDSMN1; SMN2
SCHEMBL24393050 0.73 PDE10A (0.49) MAPTKMT2ALMNAHPGDSMN1; SMN2
SCHEMBL31384279 0.72 ENPP1 (0.49) MAPTKMT2ALMNAHPGDSMN1; SMN2
SCHEMBL24000734 0.72 CD274 (0.46) MAPTKMT2AHPGDSMN1; SMN2KDM4E
SCHEMBL24341944 0.72 ENPP1 (0.48) MAPTKMT2ALMNASMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6492360-B1 Phthalazine derivatives phosphodiesterase 4 inhibitors ZAMBON GROUP S.P.A. (IT) 2002-12-10 US disclosed