SCHEMBL8651544

SCHEMBL8651544

Cc1ccc(N=Nc2c(S(=O)(=O)O)ccc3ccc(S(=O)(=O)O)cc23)c(S(=O)(=O)O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.56
▸ HIF1A Q16665 3/20 0.56
▸ CYP1A2 P05177 3/20 0.49
▸ CYP2C9 P11712 3/20 0.49
▸ ENPP2 Q13822 4/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ SUMO2 P61956 1/20 0.45
▸ SUMO1 P63165 1/20 0.45
▸ SENP7 Q9BQF6 1/20 0.45
▸ SENP3 Q9H4L4 1/20 0.45
▸ SENP2 Q9HC62 1/20 0.45
▸ SENP1 Q9P0U3 1/20 0.45
▸ CYP2C19 P33261 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ TSHR P16473 1/20 0.45
▸ PTPRA P18433 1/20 0.45
▸ PTPRB P23467 1/20 0.45

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
SCHEMBL8649035 0.83 CYP1A2 (0.56) ALDH1A1HIF1ACYP1A2CYP2C9ENPP2
SCHEMBL8649033 0.83 CYP1A2 (0.56) ALDH1A1HIF1ACYP1A2CYP2C9ENPP2
SCHEMBL9178109 0.78 SENP3 (0.56) ALDH1A1HIF1ACYP1A2CYP2C9ENPP2
SCHEMBL18218127 0.78 CTRB1 (0.53) ALDH1A1HIF1ACYP1A2CYP2C9ENPP2
SCHEMBL92161 0.77 THRB (0.69) ALDH1A1HIF1ACYP1A2CYP2C9MEN1
SCHEMBL16034162 0.76 POLB (0.55) ALDH1A1HIF1ACYP1A2CYP2C9ENPP2
SCHEMBL16034161 0.76 POLB (0.55) ALDH1A1HIF1ACYP1A2CYP2C9ENPP2
SCHEMBL27772964 0.76 THRB (0.67) ALDH1A1HIF1ACYP1A2CYP2C9MEN1
SCHEMBL9179443 0.75 SENP2 (0.58) ALDH1A1HIF1ACYP1A2CYP2C9ENPP2
SCHEMBL13763516 0.75 ENPP2 (0.69) ALDH1A1HIF1ACYP1A2CYP2C9ENPP2

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-5790627-A Method and apparatus for observing a specimen using an X-ray microscope RESEARCH DEVELOPMENT CORP. (JP) 1998-08-04 — — US disclosed
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