SCHEMBL11117431

SCHEMBL11117431

C=Cc1cccc(C=C(C(=O)O)[N+](=O)[O-])c1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 1/20 0.43
▸ FBP1 P09467 10/20 0.42
▸ GLO1 Q04760 1/20 0.40
▸ PRMT1 Q99873 1/20 0.39
▸ TP53 P04637 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL42324 0.81 FBP1 (0.58) FBP1PRMT1TP53
SCHEMBL11140787 0.81 FBP1 (0.58) FBP1PRMT1TP53
SCHEMBL6382677 0.81 FBP1 (0.58) FBP1PRMT1TP53
SCHEMBL27883556 0.80 FBP1 (0.56) FBP1PRMT1TP53
Hydrochloric Acid SCHEMBL4989759 0.80 FBP1 (0.56) FBP1PRMT1TP53
SCHEMBL27897016 0.80 FBP1 (0.56) FBP1PRMT1TP53
SCHEMBL27867388 0.80 FBP1 (0.56) FBP1PRMT1TP53
SCHEMBL10899747 0.74 ALDH1A1 (0.41) FBP1PRMT1
Styrene SCHEMBL29669765 0.74 ALDH1A1 (0.42) PTGS2FBP1PRMT1TDP1
SCHEMBL3380096 0.72 FBP1 (0.56) FBP1PRMT1

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-4455364-A ETCHING RESISTANCE KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1984-06-19 — — US disclosed
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