SCHEMBL6790635

SCHEMBL6790635

C/C(=C/C(=O)Nc1ccc(F)cc1C(=O)O)c1ccc(Br)cc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TERT O14746 5/20 0.52
AKR1C2 P52895 3/20 0.47
AKR1C3 P42330 2/20 0.47
DHODH Q02127 4/20 0.47
KCNK2 O95069 2/20 0.46
LTB4R Q15722 1/20 0.43
AKR1C1 Q04828 2/20 0.42
TRPM2 O94759 1/20 0.42
KCNK10 P57789 1/20 0.42
DEGS1 O15121 1/20 0.41
AKR1C4 P17516 1/20 0.41
TRPA1 O75762 1/20 0.41
TRPM8 Q7Z2W7 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL6787380 0.87 MEN1 (0.52) TERTAKR1C2AKR1C3DHODHKCNK2
SCHEMBL6785899 0.84 TERT (0.54) TERTDHODHKCNK2LTB4R
SCHEMBL6785956 0.83 TERT (0.53) TERTDHODHKCNK2LTB4R
SCHEMBL6783990 0.83 TERT (0.47) TERTDHODHKCNK2LTB4RDEGS1
SCHEMBL4020296 0.82 TERT (0.77) TERTDHODHKCNK2LTB4RDEGS1
SCHEMBL6788013 0.81 TERT (0.62) TERTAKR1C2AKR1C3DHODHKCNK2
SCHEMBL6781608 0.81 CYP3A4 (0.53) TERTAKR1C2AKR1C3KCNK2LTB4R
SCHEMBL6784789 0.81 SERPINE1 (0.53) TERTDHODHKCNK2DEGS1
SCHEMBL6785402 0.80 TERT (0.60) TERTAKR1C2AKR1C3DHODHKCNK2
SCHEMBL6784709 0.80 TERT (0.46) TERTDHODHKCNK2TRPM2

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 1/4885AKR1C2 1036/4885AKR1C3 1239/4885

“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.