SCHEMBL4835342

SCHEMBL4835342

COc1ccc2c(c1)C(=CC(=O)c1cccc(NS(=O)(=O)c3ccccc3I)c1)NC(C)(C)C2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.39
TCF4 P15884 1/20 0.39
CTNNB1 P35222 1/20 0.39
ALDH1A1 P00352 6/20 0.38
LMNA P02545 5/20 0.38
MAPT P10636 5/20 0.38
SMN1; SMN2 Q16637 4/20 0.38
HTT P42858 3/20 0.38
KDM4E B2RXH2 3/20 0.38
HPGD P15428 3/20 0.38
MEN1 O00255 2/20 0.38
ALOX12 P18054 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
FABP4 P15090 1/20 0.36
GAA P10253 3/20 0.36
CYP1A2 P05177 2/20 0.36
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C9 P11712 2/20 0.36
CYP2C19 P33261 2/20 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
SCHEMBL4835326 1.00 KMT2A (0.39) KMT2ATCF4CTNNB1ALDH1A1LMNA
SCHEMBL4834732 0.92 SMN1; SMN2 (0.39) KMT2AALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL4834736 0.92 SMN1; SMN2 (0.39) KMT2AALDH1A1LMNAMAPTSMN1; SMN2
SCHEMBL4838075 0.90 MAPT (0.39) KMT2ATCF4CTNNB1ALDH1A1LMNA
SCHEMBL4838064 0.90 MAPT (0.39) KMT2ATCF4CTNNB1ALDH1A1LMNA
SCHEMBL4838227 0.89 SMN1; SMN2 (0.48) KMT2AALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL4838234 0.89 SMN1; SMN2 (0.48) KMT2AALDH1A1LMNASMN1; SMN2MEN1
SCHEMBL4842084 0.87 POLB (0.45) KMT2ATCF4CTNNB1ALDH1A1LMNA
SCHEMBL4842103 0.87 POLB (0.45) KMT2ATCF4CTNNB1ALDH1A1LMNA
SCHEMBL4835335 0.86 TCF4 (0.49) KMT2ATCF4CTNNB1ALDH1A1LMNA

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-7378428-B2 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-27 US disclosed
US-20050222138-A1 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-10-06 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-20050222138-A1 Nitrogen-containing bicyclic compounds and drugs containing the same as the active ingredient PARK7, MMP8, CDK7 KMT2A 4642/4885TCF4 2483/4885CTNNB1 2100/4885

“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.