4-Nitrobenzoic Acid

4-Nitrobenzoic Acid

SCHEMBL8645150

CC(C)=CCC/C(C)=C/CC(/C=C(\C)CCC=C(C)C)OC(=O)c1ccc([N+](=O)[O-])cc1.O=C(O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
THRB P10828 1/20 0.48
TDP1 Q9NUW8 1/20 0.42
TRPV1 Q8NER1 1/20 0.42
ICMT O60725 2/20 0.40
SRD5A2 P31213 2/20 0.40
POLB P06746 1/20 0.39
FNTA P49354 1/20 0.38
FNTB P49356 1/20 0.38
PLA2G4B P0C869 1/20 0.38
ADRB2 P07550 1/20 0.38
ADRB1 P08588 1/20 0.38
ADRB3 P13945 1/20 0.38
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL8626149 0.96 MAPT (0.52) MAPTTHRBTRPV1ICMTPOLB
SCHEMBL8646997 0.86 TRPV1 (0.46) TRPV1ICMTFNTAFNTB
SCHEMBL8855946 0.85 ICMT (0.48) MAPTTHRBTRPV1ICMTPOLB
SCHEMBL8621083 0.84 MAPT (0.55) MAPTTHRBICMTPOLBADRB2
SCHEMBL8618525 0.83 TRPV1 (0.50) MAPTTRPV1FNTAFNTBLMNA
SCHEMBL6445161 0.83 TRPV1 (0.47) MAPTTRPV1ICMTPOLBFNTA
SCHEMBL8618289 0.82 TRPV1 (0.49) TRPV1FNTAFNTB
SCHEMBL8625198 0.81 TRPV1 (0.46) MAPTTRPV1ICMTPOLBFNTA
SCHEMBL8622892 0.81 TRPV1 (0.48) TRPV1FNTAFNTBLMNA
SCHEMBL8619801 0.80 TRPV1 (0.46) MAPTTRPV1FNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0711749-B1 Process for producing geranylgeraniol KURARAY CO (JP) 1998-05-20 EP disclosed
US-5663461-A HYDROLYSIS OF ESTER KURARAY CO., LTD. (JP) 1997-09-02 US disclosed
EP-0711749-A1 Process for producing geranylgeraniol KURARAY CO., LTD. (JP) 1996-05-15 EP disclosed