SCHEMBL4477876

SCHEMBL4477876

CC(C)(C)c1ccc(CNC(=O)c2cccc3c(N)cccc23)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 2/20 0.71
EPHX2 P34913 12/20 0.59
NR1H4 Q96RI1 10/20 0.56
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 1/20 0.56
HPGD P15428 1/20 0.56
RAB9A P51151 2/20 0.55
LMNA P02545 1/20 0.55
HDAC2 Q92769 2/20 0.54
HDAC3 O15379 2/20 0.53
HDAC8 Q9BY41 2/20 0.53
HDAC6 Q9UBN7 2/20 0.53
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
CYP1A2 P05177 1/20 0.52
CYP2C19 P33261 1/20 0.52
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
NPC1 O15118 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50

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
SCHEMBL28729898 0.88 KDM4E (0.72) NSD2EPHX2NR1H4KDM4EALDH1A1
SCHEMBL28042188 0.84 HDAC2 (0.69) EPHX2NR1H4HPGDRAB9ALMNA
SCHEMBL4478849 0.83 NSD2 (1.00) NSD2KDM4EALDH1A1HPGDLMNA
SCHEMBL4479111 0.80 HPGD (0.56) EPHX2NR1H4HPGDRAB9ALMNA
SCHEMBL11403224 0.76 NSD2 (0.85) NSD2KDM4EALDH1A1HPGDLMNA
SCHEMBL29454504 0.75 LMNA (0.59) EPHX2NR1H4RAB9ALMNAHDAC3
SCHEMBL17744955 0.75 EPHX2 (1.00) EPHX2NR1H4RAB9ALMNAHDAC3
SCHEMBL12993420 0.74 RAB9A (0.88) EPHX2NR1H4RAB9ALMNAHDAC3
SCHEMBL3577180 0.74 KDM4E (0.68) NSD2KDM4EALDH1A1HPGDHDAC2
SCHEMBL4455303 0.74 NSD2 (0.79) NSD2HDAC3HDAC8HDAC6

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 4 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 claimed
US-20050215645-A1 Amide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2005-09-29 US claimed
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 NSD2 639/4885EPHX2 4809/4885NR1H4 957/4885

“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.