SCHEMBL9633556

SCHEMBL9633556

[N-]=[N+]=C1C=CC(Nc2ccc(P(=O)(O)O)cc2)=CC1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
CA5A P35218 1/20 0.33
CCNT1 O60563 1/20 0.30
CDK9 P50750 1/20 0.30

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
SCHEMBL9632669 0.83 SRC (0.38) CA2
SCHEMBL9633258 0.80 TSHR (0.31)
SCHEMBL8923887 0.78 MAPT (0.38)
SCHEMBL3080719 0.77 HSD17B10 (0.37)
SCHEMBL9632659 0.77
SCHEMBL9634173 0.76 S1PR1 (0.36)
SCHEMBL9634710 0.74
Sulfuric Acid SCHEMBL6322081 0.74 PTGIR (0.39) CA2
SCHEMBL9634191 0.72 CA2 (0.30) CA2CA4CA5A
Hydrochloric Acid SCHEMBL8412073 0.72 ADRA2A (0.43)

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-0487343-A1 Process for preparing a lithographic plate Fuji Photo Film Co., Ltd. (JP) 1992-05-27 EP disclosed