4-Nitrobenzoic Acid

4-Nitrobenzoic Acid

SCHEMBL29035607

C[SiH](C)C.O=C(O)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.88

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.88
SRD5A2 P31213 2/20 0.78
MEN1 O00255 3/20 0.66
KMT2A Q03164 3/20 0.66
MAPK1 P28482 2/20 0.64
CES1 P23141 2/20 0.63
CA1 P00915 2/20 0.61
CA2 P00918 2/20 0.61
CES2 O00748 1/20 0.60
TSHR P16473 1/20 0.59
ALDH1A1 P00352 1/20 0.59
POLB P06746 1/20 0.55
GSK3B P49841 1/20 0.53
TP53 P04637 1/20 0.53
LMNA P02545 1/20 0.53
GAA P10253 1/20 0.53

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
4-Nitrobenzoic Acid SCHEMBL8766543 0.94 TDP1 (0.91) TDP1SRD5A2MEN1KMT2AMAPK1
4-Nitrobenzoic Acid SCHEMBL43476 0.94 TDP1 (1.00) TDP1SRD5A2MEN1KMT2AMAPK1
Terephthalic Acid SCHEMBL28023943 0.94 TDP1 (1.00) TDP1SRD5A2MEN1KMT2AMAPK1
4-Nitrobenzoic Acid SCHEMBL8025368 0.91 TDP1 (0.95) TDP1SRD5A2MEN1KMT2AMAPK1
4-Nitrobenzoic Acid SCHEMBL10439552 0.91 TDP1 (0.95) TDP1SRD5A2MEN1KMT2AMAPK1
4-Nitrobenzoic Acid SCHEMBL1566327 0.91 TDP1 (0.95) TDP1SRD5A2MEN1KMT2AMAPK1
4-Nitrobenzoic Acid SCHEMBL9316553 0.91 TDP1 (0.95) TDP1SRD5A2MEN1KMT2AMAPK1
4-Nitrobenzoic Acid SCHEMBL3860571 0.91 TDP1 (0.95) TDP1SRD5A2MEN1KMT2AMAPK1
4-Nitrobenzoic Acid SCHEMBL11331124 0.91 TDP1 (0.95) TDP1SRD5A2MEN1KMT2AMAPK1
4-Nitrobenzoic Acid SCHEMBL17332065 0.91 TDP1 (0.95) TDP1SRD5A2MEN1KMT2AMAPK1

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
CN-110233289-B High-voltage additive, electrolyte containing same and battery 李秀艳 2023-06-20 CN claimed
CN-110233289-B High-voltage additive, electrolyte containing same and battery 李秀艳 2023-06-20 CN disclosed