SCHEMBL7436409

SCHEMBL7436409

Clc1cccc(-c2cc(Cc3ncc[nH]3)cc3cccnc23)c1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 14/20 0.53
PDE4B Q07343 11/20 0.53
PDE4C Q08493 11/20 0.53
PDE4D Q08499 11/20 0.53
NUDT1 P36639 1/20 0.43
TAAR1 Q96RJ0 4/20 0.42
ADRA2A P08913 1/20 0.39
ADRA2B P18089 1/20 0.39
ADRA2C P18825 1/20 0.39

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
Hydrochloric Acid SCHEMBL7438959 0.99 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DNUDT1
SCHEMBL7440230 0.82 PDE4A (0.71) PDE4APDE4BPDE4CPDE4D
SCHEMBL7437896 0.81 PDE4A (0.69) PDE4APDE4BPDE4CPDE4D
SCHEMBL7441348 0.80 PDE4A (0.55) PDE4APDE4BPDE4CPDE4D
SCHEMBL7434374 0.80 PDE4A (0.55) PDE4APDE4BPDE4CPDE4D
SCHEMBL7450702 0.79 PDE4A (0.60) PDE4APDE4BPDE4CPDE4D
SCHEMBL7436994 0.79 PDE4A (0.63) PDE4APDE4BPDE4CPDE4D
Hydrochloric Acid SCHEMBL8546384 0.79 PDE4A (0.54) PDE4APDE4BPDE4CPDE4D
SCHEMBL7448938 0.77 PDE4A (0.60) PDE4APDE4BPDE4CPDE4D
SCHEMBL7443505 0.76 PDE4A (0.59) PDE4APDE4BPDE4CPDE4D

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-0691966-B1 QUINOLINES AS TYPE IV PHOSPHODIESTERASE INHIBITORS SYNTEX INC (US) 1998-09-09 EP disclosed
EP-0691966-A1 QUINOLINES AS TYPE IV PHOSPHODIESTERASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1996-01-17 EP disclosed
WO-1994022852-A1 QUINOLINES AS TYPE IV PHOSPHODIESTERASE INHIBITORS SYNTEX (U.S.A.) INC. (US) 1994-10-13 WO disclosed