SCHEMBL4878029

SCHEMBL4878029

Nc1cccc(-c2ccc3cc(-c4c(-c5ccccc5)c5sc(C(=O)O)cc5n4CC(=O)N4CCC(O)CC4)ccc3n2)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMO Q99835 1/20 0.34
ALDH1A1 P00352 3/20 0.33
KMT2A Q03164 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GAA P10253 1/20 0.33
PIK3CA P42336 5/20 0.33
MTOR P42345 5/20 0.33
LMNA P02545 4/20 0.33
MAPT P10636 4/20 0.32
HTT P42858 3/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
TNKS O95271 1/20 0.31
PARP1 P09874 1/20 0.31
PARP2 Q9UGN5 1/20 0.31
MAP4K4 O95819 1/20 0.31
BRD4 O60885 1/20 0.31
CREBBP Q92793 1/20 0.31
F2 P00734 1/20 0.31
F10 P00742 1/20 0.31

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
SCHEMBL4876271 0.92 HPGD (0.31) ALDH1A1KMT2ASMN1; SMN2GAAMAPT
SCHEMBL4877234 0.91 IRAK4 (0.31) MAPT
SCHEMBL4873226 0.90 CBX7 (0.39) SMOGAAPIK3CAMTORPOLB
SCHEMBL4877128 0.90 LMNA (0.36) SMOALDH1A1KMT2ASMN1; SMN2GAA
SCHEMBL4875677 0.90 GRIN2B (0.34) SMOALDH1A1KMT2ASMN1; SMN2GAA
SCHEMBL4878001 0.89 ALDH1A1 (0.34) SMOALDH1A1KMT2ASMN1; SMN2GAA
SCHEMBL4877312 0.89 PIK3CA (0.43) SMOALDH1A1KMT2ASMN1; SMN2PIK3CA
SCHEMBL4866875 0.88 ALDH1A1 (0.39) ALDH1A1KMT2ASMN1; SMN2GAAPIK3CA
SCHEMBL4872104 0.88 KDM4E (0.40) ALDH1A1KMT2ASMN1; SMN2LMNAMAPT
SCHEMBL4877141 0.88 LMNA (0.36) SMOALDH1A1KMT2ASMN1; SMN2PIK3CA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 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-20080051384-A1 ANTIVIRAL AGENTS EIF2AK2, MAVS, ZC3HAV1 SMO 4550/4885ALDH1A1 1357/4885KMT2A 4254/4885

“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.