SCHEMBL4479111

SCHEMBL4479111

CC(C)(C)c1ccc(CNC(=O)c2cccc3c([N+](=O)[O-])cccc23)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.56
RAB9A P51151 2/20 0.50
LMNA P02545 1/20 0.50
EPHX2 P34913 10/20 0.49
NR1H4 Q96RI1 7/20 0.49
HDAC3 O15379 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
TDP1 Q9NUW8 1/20 0.48
NPC1 O15118 1/20 0.48
GAA P10253 1/20 0.48
MAPK1 P28482 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
CYP1A2 P05177 2/20 0.48
CYP2C19 P33261 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
HTT P42858 1/20 0.47
CYP3A4 P08684 1/20 0.47
CA1 P00915 1/20 0.47

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
SCHEMBL4476754 0.85 NSD2 (0.62) HPGDLMNAGAAMAPK1SMN1; SMN2
SCHEMBL4477876 0.80 NSD2 (0.71) HPGDRAB9ALMNAEPHX2NR1H4
SCHEMBL28042188 0.80 HDAC2 (0.69) HPGDRAB9ALMNAEPHX2NR1H4
SCHEMBL8132911 0.76 TDP1 (0.49) HPGDLMNATDP1MAPK1SMN1; SMN2
SCHEMBL19246212 0.75 HPGD (0.74) HPGDLMNAGAACYP1A2CYP2C19
SCHEMBL30236290 0.74 KMT2A (0.75) HPGDLMNAGAACYP1A2CYP2C19
SCHEMBL19246188 0.74 KMT2A (0.75) HPGDLMNAGAACYP1A2CYP2C19
SCHEMBL28729898 0.73 KDM4E (0.72) HPGDRAB9ALMNAEPHX2NR1H4
SCHEMBL7160222 0.73 HPGD (0.62) HPGDLMNAGAACYP1A2CYP2C19
SCHEMBL9647881 0.73 HPGD (0.72) HPGDLMNATDP1SMN1; SMN2CYP1A2

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
US-7598418-B2 Naphthalene-1-(sulfonamide or carboxamide) derivatives; e.g. N-Benzyl-5-{[(4-methylphenyl)sulfonyl]oxy}naphthalene-1-sulfonamide; protein kinase inhibitors sensitize cancer cells to radiotherapy or anticancer agents; side effect reduction INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2009-10-06 US disclosed
US-20050215645-A1 Amide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2005-09-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050215645-A1 Amide derivatives OGG1, HDAC1, BCL2A1 HPGD 225/4885RAB9A 3110/4885LMNA 941/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.