SCHEMBL4025006

SCHEMBL4025006

C/C(=C/C(=O)Nc1ccccc1C(=O)O)c1ccc2ncccc2c1

nearest known ligand 0.73

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TERT O14746 5/20 0.73
HDAC1 Q13547 1/20 0.50
HDAC2 Q92769 1/20 0.50
MAPK8 P45983 1/20 0.48
ALOX15 P16050 1/20 0.48
HTT P42858 1/20 0.48
PLK1 P53350 1/20 0.48
ALDH1A1 P00352 3/20 0.47
RAB9A P51151 3/20 0.47
GAA P10253 2/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
LMNA P02545 1/20 0.47
BCAT1 P54687 1/20 0.46
PABPC1 P11940 1/20 0.46
NPC1 O15118 2/20 0.43
POLB P06746 1/20 0.43
MCL1 Q07820 1/20 0.43
KDM4E B2RXH2 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
SCHEMBL7240960 0.89 TERT (0.58) TERTHDAC1HDAC2ALOX15HTT
SCHEMBL29355750 0.85 TERT (1.00) TERTALDH1A1RAB9ANPC1KDM4E
SCHEMBL29362821 0.85 TERT (1.00) TERTALDH1A1RAB9ANPC1KDM4E
SCHEMBL16964998 0.85 TERT (1.00) TERTALDH1A1RAB9ANPC1KDM4E
SCHEMBL30760782 0.85 TERT (1.00) TERTALDH1A1RAB9ANPC1KDM4E
SCHEMBL29966843 0.85 TERT (1.00) TERTALDH1A1RAB9ANPC1KDM4E
SCHEMBL4022937 0.85 TERT (1.00) TERTALDH1A1RAB9ANPC1KDM4E
SCHEMBL6790528 0.80 TERT (0.69) TERTHTTALDH1A1RAB9AGAA
SCHEMBL6785154 0.80 TERT (0.84) TERTALDH1A1RAB9AMAPTSMN1; SMN2
SCHEMBL6786614 0.79 TERT (0.59) TERTHDAC1HDAC2ALOX15HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110054034-A1 METHODS OF USING CARBOXYLIC AMIDES AS ANTIMICROBIAL AGENTS GRAND VALLEY STATE UNIVERSITY 2011-03-03 US claimed
WO-2009100323-A2 METHODS OF USING CARBOXYLIC AMIDES AS ANTIMICROBIAL AGENTS GRAND VALLEY STATE UNIVERSITY (US) 2009-08-13 WO claimed
US-20020123509-A1 Carboxylic acid amides, pharmaceutical compositions containing these compounds, their use and the preparation thereof BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-09-05 US claimed
WO-2002051830-A1 CARBOXAMIDES FOR USE AS TELOMERASE INHIBITORS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-07-04 WO claimed
US-20110054034-A1 METHODS OF USING CARBOXYLIC AMIDES AS ANTIMICROBIAL AGENTS GRAND VALLEY STATE UNIVERSITY 2011-03-03 US disclosed
WO-2009100323-A2 METHODS OF USING CARBOXYLIC AMIDES AS ANTIMICROBIAL AGENTS GRAND VALLEY STATE UNIVERSITY (US) 2009-08-13 WO disclosed
US-6660764-B2 Telomerase inhibitors such as trans-3-(benzothien-6-yl)-but-2-enoic acid-N-(2-carboxy-phenyl)-amide; use as antitumor agent BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-12-09 US disclosed
US-20020123509-A1 Carboxylic acid amides, pharmaceutical compositions containing these compounds, their use and the preparation thereof BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-09-05 US disclosed
WO-2002051830-A1 CARBOXAMIDES FOR USE AS TELOMERASE INHIBITORS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-07-04 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 (2 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-20110054034-A1 METHODS OF USING CARBOXYLIC AMIDES AS ANTIMICROBIAL AGENTS NAAA, ELANE, APEH TERT 1053/4885HDAC1 1270/4885HDAC2 1304/4885
US-20020123509-A1 Carboxylic acid amides, pharmaceutical compositions containing these compounds, their use and the preparation thereof ASS1, ADCY1, ADCY3 TERT 4749/4885HDAC1 461/4885HDAC2 628/4885

“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.