SCHEMBL11475303

SCHEMBL11475303

CCCCCSc1nnc(-c2ccc(N(CC)CC)cc2)c(-c2ccc(N(CC)CC)cc2)n1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 4/20 0.67
▸ HPGD P15428 1/20 0.45
▸ RECQL P46063 1/20 0.45
▸ GPR84 Q9NQS5 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ TP53 P04637 1/20 0.39
▸ MAPT P10636 4/20 0.39
▸ NPSR1 Q6W5P4 3/20 0.39
▸ HTT P42858 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
SCHEMBL11485804 0.90 PTGES (0.53) PTGESHPGDRECQLALDH1A1LMNA
SCHEMBL11483877 0.84 HPGD (0.50) PTGESHPGDRECQLALDH1A1LMNA
SCHEMBL11469614 0.83 PTGES (0.48) PTGESHPGDRECQLALDH1A1LMNA
SCHEMBL11468302 0.81 NPSR1 (0.58) PTGESHPGDRECQLALDH1A1LMNA
SCHEMBL11484216 0.81 PTGES (0.46) PTGESHPGDRECQLGPR84ALDH1A1
SCHEMBL11477119 0.80 PTGES (1.00) PTGESTP53MAPT
SCHEMBL11485827 0.79 PTGES (0.79) PTGESHPGDRECQLLMNATP53
SCHEMBL11485871 0.79 PTGES (0.53) PTGESHPGDRECQLALDH1A1LMNA
SCHEMBL31582268 0.79 PTGES (0.63) PTGESHPGDRECQLGPR84ALDH1A1
SCHEMBL11479740 0.78 PTGES (0.73) PTGESLMNATP53MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4190725-A ANTIINFLAMMATORY ELI LILLY AND COMPANY (US) 1980-02-26 — — US disclosed
US-4021553-A 5,6-Diaryl-1,2,4-triazines as topically-active anti-inflammatory agents ELI LILLY AND COMPANY (US) 1977-05-03 — — US disclosed
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