SCHEMBL4024629

SCHEMBL4024629

C/C(=C/C(=O)Nc1cc(F)c(F)cc1C(=O)O)c1ccc2ccccc2c1

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TERT O14746 5/20 0.74
DHODH Q02127 3/20 0.45
LTB4R Q15722 1/20 0.44
KDM4E B2RXH2 1/20 0.42
PTPN1 P18031 1/20 0.42
ABCC1 P33527 1/20 0.40
DEGS1 O15121 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40

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
SCHEMBL6783614 0.90 TERT (0.81) TERTDHODHLTB4RKDM4EPTPN1
SCHEMBL4020296 0.87 TERT (0.77) TERTDHODHLTB4RKDM4EDEGS1
SCHEMBL4020307 0.87 TERT (0.77) TERTDHODHLTB4RKDM4E
SCHEMBL6783732 0.86 TERT (0.85) TERTDHODHLTB4RKDM4EPTPN1
SCHEMBL29966843 0.85 TERT (1.00) TERTDHODHLTB4RKDM4EDEGS1
SCHEMBL29355750 0.85 TERT (1.00) TERTDHODHLTB4RKDM4EDEGS1
SCHEMBL29362821 0.85 TERT (1.00) TERTDHODHLTB4RKDM4EDEGS1
SCHEMBL16964998 0.85 TERT (1.00) TERTDHODHLTB4RKDM4EDEGS1
SCHEMBL30760782 0.85 TERT (1.00) TERTDHODHLTB4RKDM4EDEGS1
SCHEMBL4022937 0.85 TERT (1.00) TERTDHODHLTB4RKDM4EDEGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
US-6362210-B1 ANTITUMOR, ANTICANCER AGENT BOEHRINGER INGELHEIM PHARMA KG (DE) 2002-03-26 US 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-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 (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 1053/4885DHODH 700/4885LTB4R 1900/4885
US-20020099089-A1 Carboxylic acid amides, pharmaceutical compositions containing these compounds, their use and preparation TERT, NAT1, POT1 TERT 1/4885DHODH 1011/4885LTB4R 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.