SCHEMBL3754165

SCHEMBL3754165

C#CCN(C)S(=O)(=O)c1ccc(Cn2nc(C(=O)Nc3ccc(N4CCCCC4)cc3)c3ccccc32)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.42
KDM4E B2RXH2 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
ALOX15 P16050 1/20 0.42
TDP1 Q9NUW8 3/20 0.41
MAPT P10636 7/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
RAB9A P51151 5/20 0.40
NPC1 O15118 3/20 0.40
PKM P14618 2/20 0.40
MAPK1 P28482 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
HTT P42858 1/20 0.40
KLF5 Q13887 1/20 0.40
LMNA P02545 1/20 0.40
MAP4K4 O95819 1/20 0.39

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
SCHEMBL3428566 0.87 SMN1; SMN2 (0.49) ALDH1A1KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL3762387 0.86 KDM4E (0.42) KDM4EMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL3760152 0.86 PTGER4 (0.44) ALDH1A1KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL3430258 0.85 MAPT (0.52) ALDH1A1KDM4ETDP1MAPTSMN1; SMN2
SCHEMBL13672186 0.84 IDH1 (0.51) ALDH1A1KDM4ETDP1MAPTSMN1; SMN2
SCHEMBL3430845 0.83 KMT2A (0.45) ALDH1A1KDM4EALOX15MAPTMEN1
SCHEMBL3751881 0.80 MAPT (0.50) ALDH1A1KDM4ETDP1MAPTSMN1; SMN2
SCHEMBL3759797 0.80 TDP1 (0.48) ALDH1A1TDP1MAPTSMN1; SMN2RAB9A
SCHEMBL3429962 0.77 MAPT (0.44) ALDH1A1KDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL3755332 0.75 KDM4E (0.54) KDM4EMEN1KMT2AMAPK1MCL1

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-20100305120-A1 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY BIOMARIN IGA LIMITED 2010-12-02 US claimed
US-20100305120-A1 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY BIOMARIN IGA LIMITED 2010-12-02 US disclosed
US-20100305120-A1 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY BIOMARIN IGA LIMITED 2010-12-02 US disclosed
US-20100305120-A1 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY BIOMARIN IGA LIMITED 2010-12-02 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-20100305120-A1 COMPOUNDS FOR TREATING MUSCULAR DYSTROPHY CPT1B, SMN1; SMN2, GYS1 ALDH1A1 359/4885KDM4E 1965/4885CYP1A2 2119/4885

“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.