SCHEMBL6784006

SCHEMBL6784006

COC(=O)c1ccc(C(=O)NC2CC2)cc1NC(=O)/C=C(/C)c1ccc2ccccc2c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TERT O14746 5/20 0.55
KDM4E B2RXH2 3/20 0.48
ALDH1A1 P00352 2/20 0.48
ALOX12 P18054 1/20 0.48
DRD4 P21917 6/20 0.46
SMYD3 Q9H7B4 1/20 0.44
HPGDS O60760 1/20 0.43
RAB9A P51151 1/20 0.43
SLC6A12 P48065 1/20 0.43
SLC6A13 Q9NSD5 1/20 0.43
ATM Q13315 1/20 0.43
LTB4R Q15722 1/20 0.42
TSHR P16473 1/20 0.42
MAPK10 P53779 1/20 0.42
SMN1; SMN2 Q16637 1/20 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
SCHEMBL6784963 0.96 TERT (0.53) TERTKDM4EALDH1A1ALOX12DRD4
SCHEMBL6784228 0.96 TERT (0.53) TERTKDM4EALDH1A1ALOX12DRD4
SCHEMBL6785713 0.95 TERT (0.52) TERTKDM4EALDH1A1ALOX12DRD4
SCHEMBL6791574 0.90 TERT (0.68) TERTKDM4EDRD4RAB9ASLC6A12
SCHEMBL6784370 0.87 TERT (0.62) TERTKDM4EALDH1A1ALOX12RAB9A
SCHEMBL6782397 0.87 TERT (0.64) TERTKDM4EALDH1A1ALOX12ATM
SCHEMBL6786405 0.86 TERT (0.66) TERTKDM4EALDH1A1DRD4SLC6A12
SCHEMBL6786598 0.86 TERT (0.66) TERTKDM4EDRD4RAB9ASLC6A12
SCHEMBL6781040 0.86 TERT (0.59) TERTKDM4EALDH1A1ALOX12RAB9A
SCHEMBL6786925 0.86 TERT (0.64) TERTKDM4EALDH1A1DRD4RAB9A

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 5 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
EP-1261321-A2 CARBOXYLIC ACID AMIDES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND THE USE AND PRODUCTION THEREOF Boehringer Ingelheim Pharma KG (DE) 2002-12-04 EP 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
WO-2001007020-A2 CARBOXYLIC ACID AMIDES, MEDICAMENTS CONTAINING THESE COMPOUNDS AND THE USE AND PRODUCTION THEREOF BOEHRINGER INGELHEIM PHARMA KG (DE) 2001-02-01 WO 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 1243/4885ALDH1A1 102/4885

“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.