SCHEMBL11546405

SCHEMBL11546405

[O-][n+]1cccc(Oc2ccc(Cl)cc2)c1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 11/20 0.58
PGR P06401 3/20 0.44
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
PTGES2 Q9H7Z7 1/20 0.39
CTSG P08311 1/20 0.39
CMA1 P23946 1/20 0.39
NR3C1 P04150 1/20 0.38
MMP2 P08253 1/20 0.38
MMP9 P14780 1/20 0.38

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
SCHEMBL7263349 0.84 LTA4H (0.52) GPR84MAOAMAOBLMNA
SCHEMBL11548399 0.82 GPR84 (0.48) GPR84PGR
SCHEMBL26416085 0.81 HTT (0.51) GPR84ALDH1A1NR3C1MMP2MMP9
SCHEMBL28689451 0.81 SOS1 (0.46) GPR84ALDH1A1LMNANR3C1MMP2
SCHEMBL31220874 0.81 SOS1 (0.46) GPR84ALDH1A1LMNANR3C1MMP2
SCHEMBL6754325 0.77 CYP19A1 (0.49) GPR84PGRMAOBLMNANR3C1
SCHEMBL11458026 0.75 GPR84 (0.44) GPR84
SCHEMBL6755608 0.75 PARP10 (0.41) GPR84ALDH1A1
SCHEMBL196125 0.73 LTA4H (0.67) PGRMAOAMAOB
SCHEMBL9242729 0.72 MAOA (0.74) MAOAMAOBALDH1A1LMNAMMP2

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-4179563-A COGNITION ACTIVATORS WARNER-LAMBERT COMPANY (US) 1979-12-18 US disclosed