SCHEMBL7593014

SCHEMBL7593014

CCC(=O)Nc1ccc(C(=O)O)cc1C(C)N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
POLB P06746 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
APOBEC3A P31941 1/20 0.47
RECQL P46063 1/20 0.47
APOBEC3G Q9HC16 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ALDH1A1 P00352 4/20 0.46
KDM4E B2RXH2 3/20 0.46
GAA P10253 3/20 0.46
HTT P42858 2/20 0.46
HPGD P15428 2/20 0.46
THRB P10828 1/20 0.46
GFER P55789 1/20 0.46
PLEC Q15149 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.43
PKM P14618 1/20 0.43
HCAR3 P49019 2/20 0.42

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
SCHEMBL7596906 0.84 NEU3 (0.55) MAPTMEN1KMT2APOLBTDP1
SCHEMBL7593081 0.81 HCAR3 (0.50) MAPTMEN1KMT2APOLBTDP1
SCHEMBL22411255 0.77 MEN1 (0.56) MAPTMEN1KMT2APOLBTDP1
SCHEMBL30873828 0.77 MEN1 (0.56) MAPTMEN1KMT2APOLBTDP1
SCHEMBL7594615 0.74 GRM1 (0.56) MAPTMEN1KMT2APOLBTDP1
SCHEMBL7593018 0.74 MAPT (0.47) MAPTMEN1KMT2APOLBTDP1
SCHEMBL6172138 0.71 HCAR3 (0.70) MAPTMEN1KMT2AHCAR3
SCHEMBL2217173 0.71 LTB4R (0.66) MAPTMEN1KMT2APOLBTDP1
SCHEMBL31253047 0.70 MAPT (0.51) MAPTMEN1KMT2APOLBTDP1
SCHEMBL8390216 0.69 MAPT (0.53) MAPTMEN1KMT2ATDP1L3MBTL1

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-20020082280-A1 Method of inhibiting neoplastic cells with benzimidazole derivatives OSI PHARMACEUTICALS, INC. 2002-06-27 US disclosed
US-6348032-B1 POTENT COMPOUNDS THAT INDUCE APOPTOSIS IN NEOPLASTIC CELLS (BUT NOT SUBSTANTIALLY IN NORMAL CELLS), WITHOUT SUBSTANTIALLY INHIBITING PGE-2. CELL PATHWAYS, INC. 2002-02-19 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-20020082280-A1 Method of inhibiting neoplastic cells with benzimidazole derivatives MKI67, CCNI, TMBIM6 MAPT 4390/4885MEN1 1677/4885KMT2A 1590/4885

“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.