SCHEMBL6786807

SCHEMBL6786807

C/C(=C/C(=O)Nc1cc(C(=O)NNC(=O)OC(C)(C)C)ccc1C(=O)O)c1ccc2ccccc2c1

nearest known ligand 0.66

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TERT O14746 5/20 0.66
KDM4E B2RXH2 2/20 0.44
LTB4R Q15722 1/20 0.41
KAT6A Q92794 1/20 0.41
DHODH Q02127 1/20 0.41
GABRB1 P18505 1/20 0.40
GABRB2 P47870 1/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.38
ALDH1A1 P00352 1/20 0.38
ALOX12 P18054 1/20 0.38
NR1H4 Q96RI1 1/20 0.37

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
SCHEMBL6786287 0.92 TERT (0.54) TERTKDM4ELTB4RKAT6AKMT2A
SCHEMBL6784656 0.88 TERT (0.60) TERTKDM4ELTB4RGABRB1GABRB2
SCHEMBL6792283 0.87 TERT (0.76) TERTKDM4ELTB4RDHODHKMT2A
SCHEMBL6786325 0.85 TERT (0.76) TERTKDM4ELTB4RDHODHKMT2A
SCHEMBL6785021 0.83 TERT (0.78) TERTKDM4ELTB4RDHODHKMT2A
SCHEMBL6787182 0.83 TERT (0.66) TERTKDM4ELTB4RKAT6ADHODH
SCHEMBL6783732 0.83 TERT (0.85) TERTKDM4ELTB4RDHODHNR1H4
SCHEMBL6790543 0.82 TERT (0.71) TERTKDM4ELTB4RDHODHALDH1A1
SCHEMBL6783748 0.82 TERT (0.71) TERTKDM4ELTB4RDHODH
SCHEMBL6785371 0.82 TERT (0.73) TERTKDM4EDHODHKMT2AMEN1

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 1/4885KDM4E 1243/4885LTB4R 3433/4885

“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.