SCHEMBL5652653

SCHEMBL5652653

NC(C(=O)COc1ccc(Br)cc1)C(=O)NC1CCCc2ccccc21

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TAOK1 Q7L7X3 5/20 0.66
KMT2A Q03164 4/20 0.55
LMNA P02545 2/20 0.55
TAOK3 Q9H2K8 4/20 0.53
ALDH1A1 P00352 6/20 0.52
HPGD P15428 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
GAA P10253 1/20 0.50
MAPT P10636 1/20 0.50
MEN1 O00255 1/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
PLA2G1B P04054 1/20 0.48
ATG4B Q9Y4P1 1/20 0.48

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
SCHEMBL5652164 0.90 TAOK3 (0.66) TAOK1KMT2ALMNATAOK3ALDH1A1
SCHEMBL5654657 0.88 TAOK1 (0.67) TAOK1KMT2ALMNATAOK3ALDH1A1
SCHEMBL5652350 0.87 TAOK1 (0.68) TAOK1KMT2ALMNATAOK3ALDH1A1
SCHEMBL5653045 0.83 TAOK1 (0.68) TAOK1KMT2ALMNATAOK3ALDH1A1
SCHEMBL5652656 0.82 TAOK1 (0.61) TAOK1KMT2ALMNATAOK3ALDH1A1
SCHEMBL5223796 0.80 TAOK1 (1.00) TAOK1KMT2ALMNATAOK3ALDH1A1
SCHEMBL31458362 0.80 TAOK1 (1.00) TAOK1KMT2ALMNATAOK3ALDH1A1
SCHEMBL29131608 0.73 HTT (0.60) TAOK1KMT2ATAOK3ALDH1A1L3MBTL1
SCHEMBL29131611 0.73 HTT (0.60) TAOK1KMT2ATAOK3ALDH1A1L3MBTL1
SCHEMBL29131615 0.72 KMT2A (0.56) KMT2AALDH1A1L3MBTL1MEN1HTT

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-20070208166-A1 Tao Kinase Modulators And Method Of Use EXELIXIS, INC. (US) 2007-09-06 US claimed
US-20070208166-A1 Tao Kinase Modulators And Method Of Use EXELIXIS, INC. (US) 2007-09-06 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-20070208166-A1 Tao Kinase Modulators And Method Of Use TAOK1, TAOK3, MAP3K6 TAOK1 1/4885KMT2A 2240/4885LMNA 3822/4885

“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.