SCHEMBL4842270

SCHEMBL4842270

COc1ccc2c(c1)C(=CC(=O)c1ccc(NC(=O)OCC(C)C)cc1)NC(C)(C)C2

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 3/20 0.41
KDM4E B2RXH2 2/20 0.41
CYP1A2 P05177 4/20 0.39
CYP2D6 P10635 4/20 0.39
CYP2C9 P11712 4/20 0.39
CYP2C19 P33261 4/20 0.39
ALDH1A1 P00352 4/20 0.39
HPGD P15428 3/20 0.39
CYP3A4 P08684 2/20 0.39
GAA P10253 2/20 0.39
NAMPT P43490 1/20 0.37
MAPT P10636 6/20 0.36
NPC1 O15118 3/20 0.36
HTT P42858 2/20 0.36
KMT2A Q03164 3/20 0.35
MEN1 O00255 1/20 0.35
PKM P14618 1/20 0.35
MAPK1 P28482 1/20 0.35
CASP1 P29466 1/20 0.35

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
SCHEMBL4842262 1.00 SMN1; SMN2 (0.41) SMN1; SMN2LMNAKDM4ECYP1A2CYP2D6
SCHEMBL4844488 0.91 KMT2A (0.40) SMN1; SMN2LMNAKDM4ECYP1A2CYP2D6
SCHEMBL4844478 0.91 KMT2A (0.40) SMN1; SMN2LMNAKDM4ECYP1A2CYP2D6
SCHEMBL4841967 0.90 KDM4E (0.49) LMNAKDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL4841954 0.90 KDM4E (0.49) LMNAKDM4ECYP1A2CYP2D6CYP2C9
SCHEMBL4839999 0.90 KDM4E (0.42) SMN1; SMN2LMNAKDM4ECYP1A2CYP2D6
SCHEMBL4839986 0.90 KDM4E (0.42) SMN1; SMN2LMNAKDM4ECYP1A2CYP2D6
SCHEMBL4839126 0.89 KDM4E (0.41) SMN1; SMN2LMNAKDM4ECYP1A2CYP2D6
SCHEMBL4835307 0.89 LMNA (0.43) SMN1; SMN2LMNAKDM4ECYP1A2CYP2D6
SCHEMBL4835291 0.89 LMNA (0.43) SMN1; SMN2LMNAKDM4ECYP1A2CYP2D6

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 SMN1; SMN2 144/4885LMNA 3014/4885KDM4E 4466/4885

“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.