SCHEMBL6791642

SCHEMBL6791642

C/C(=C/C(=O)Nc1ccc(N(C)C(=O)OC(C)(C)C)cc1C(=O)O)c1ccc2ccccc2c1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TERT O14746 5/20 0.62
LTB4R Q15722 1/20 0.39
DHODH Q02127 1/20 0.38
KDM4E B2RXH2 1/20 0.37
GABRB1 P18505 1/20 0.36
GABRB2 P47870 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PAX8 Q06710 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
SCHEMBL6790905 0.90 TERT (0.51) TERTKDM4EALDH1A1SMN1; SMN2
SCHEMBL4022951 0.85 TERT (0.73) TERTLTB4RDHODHKDM4E
SCHEMBL6787182 0.82 TERT (0.66) TERTLTB4RDHODHKDM4EGABRB1
SCHEMBL6784227 0.80 TERT (0.66) TERTLTB4RDHODHKDM4E
SCHEMBL6781404 0.80 TERT (0.66) TERTDHODH
SCHEMBL6784294 0.80 TERT (0.62) TERTLTB4R
SCHEMBL4024783 0.79 TERT (0.80) TERTLTB4RDHODHKDM4EMEN1
SCHEMBL6790890 0.79 TERT (0.63) TERTDHODH
SCHEMBL6785756 0.79 TERT (0.63) TERTLTB4RDHODHKDM4E
SCHEMBL6786289 0.79 TERT (0.63) TERTDHODH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6727250-B2 ADMINISTERING COMPOUNDS SUCH AS TRANS-3-(NAPHTH-2-YL)-BUT-2-ENOIC ACID-N-(2-CARBOXY-PHENYL)-AMIDE OR LIKE FOR THERAPY OF CONDITIONS ASSOCIATED WITH INCREASED TELOMERASE ACTIVITY, E.G. TUMOUR DISEASES BOEHRINGER INGELHEIM PHARMA KG (DE) 2004-04-27 US disclosed
US-20020099089-A1 Carboxylic acid amides, pharmaceutical compositions containing these compounds, their use and preparation BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-07-25 US disclosed
US-6362210-B1 ANTITUMOR, ANTICANCER AGENT BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-03-26 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-20020099089-A1 Carboxylic acid amides, pharmaceutical compositions containing these compounds, their use and preparation TERT, NAT1, POT1 TERT 1/4885LTB4R 3433/4885DHODH 1011/4885

“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.