SCHEMBL9854319

SCHEMBL9854319

N#Cc1ccccc1-c1ccc(Cn2c(-c3ccccc3)nc3cccnc32)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.53
PPARG P37231 2/20 0.52
ALDH1A1 P00352 5/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
LMNA P02545 3/20 0.44
KDM4E B2RXH2 2/20 0.44
RECQL P46063 1/20 0.44
RAB9A P51151 1/20 0.44
HPGD P15428 1/20 0.44
PDE6D O43924 1/20 0.44
ALDH2 P05091 1/20 0.44
ALDH3A1 P30838 1/20 0.44
TP53 P04637 1/20 0.44
AGTR1 P30556 2/20 0.43
AGTR2 P50052 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
CNR2 P34972 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42

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
SCHEMBL9854386 0.86 PPARG (0.53) BRD4PPARGLMNAAGTR1AGTR2
SCHEMBL8566073 0.84 PPARG (0.61) BRD4PPARGLMNARAB9ATP53
SCHEMBL9853637 0.82 PPARG (0.74) PPARGLMNATP53AGTR1AGTR2
SCHEMBL9854307 0.82 PPARG (0.49) BRD4PPARGLMNAAGTR1AGTR2
SCHEMBL9854355 0.81 PPARG (0.53) PPARGALDH1A1LMNAHPGDTP53
SCHEMBL8874596 0.81 PPARG (0.53) BRD4PPARGLMNATP53AGTR1
SCHEMBL9851543 0.81 AGTR1 (0.66) PPARGALDH1A1LMNAAGTR1AGTR2
SCHEMBL9854316 0.80 PPARG (0.47) PPARGALDH1A1LMNAHPGDTP53
SCHEMBL9854341 0.80 PPARG (0.54) PPARGALDH1A1LMNAHPGDTP53
SCHEMBL8874522 0.77 MEN1 (0.53) PPARGSMN1; SMN2LMNATP53AGTR2

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
EP-0426021-A1 Condensed imidazole derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1991-05-08 EP disclosed