SCHEMBL4658248

SCHEMBL4658248

CCCc1cc(N2CCC(NCC(O)c3cccc4ccccc34)CC2)nc2sc(C(N)=O)c(N)c12

nearest known ligand 0.67

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 20/20 0.67
CHUK O15111 4/20 0.62
EPHA3 P29320 3/20 0.62
NTRK1 P04629 1/20 0.62
PDGFRA P16234 1/20 0.56

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
SCHEMBL6282636 0.91 IKBKB (0.68) IKBKBCHUKEPHA3NTRK1PDGFRA
SCHEMBL4917527 0.90 IKBKB (0.63) IKBKBCHUKEPHA3NTRK1PDGFRA
SCHEMBL4718612 0.89 IKBKB (0.52) IKBKBCHUKEPHA3NTRK1PDGFRA
SCHEMBL4922537 0.89 IKBKB (0.64) IKBKBCHUKEPHA3NTRK1PDGFRA
SCHEMBL4912375 0.89 IKBKB (0.64) IKBKBCHUKEPHA3NTRK1PDGFRA
SCHEMBL4920056 0.89 IKBKB (0.64) IKBKBCHUKEPHA3NTRK1PDGFRA
SCHEMBL4657009 0.89 IKBKB (0.72) IKBKBCHUKEPHA3NTRK1PDGFRA
SCHEMBL4657586 0.89 IKBKB (0.72) IKBKBCHUKEPHA3NTRK1PDGFRA
SCHEMBL4657585 0.89 IKBKB (0.72) IKBKBCHUKEPHA3NTRK1PDGFRA
SCHEMBL6285001 0.88 IKBKB (0.68) IKBKBCHUKEPHA3NTRK1PDGFRA

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 34 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115536646-A Nematicidal active compound and preparation method and application thereof 华东理工大学 2022-12-30 CN claimed
EP-2008654-A1 3-amino-thieno[2,3-b]pyridine-2-carboxylic acid amides Boehringer Ingelheim Pharmaceuticals, Inc. (US) 2008-12-31 EP claimed
EP-1513516-B1 SUBSTITUTED 3-AMINO-THIENO(2,3-b) PYRIDINE-2-CARBOXYLIC ACID AMIDE COMPOUNDS AND PROCESSES FOR PREPARING AND THEIR USES BOEHRINGER INGELHEIM PHARMA (US) 2008-12-03 EP claimed
US-20050288285-A1 Substituted 3-amino-thieno[2,3-b]pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-12-29 US claimed
US-6974870-B2 Substituted 3-amino-thieno [2,3-b]pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses BOEHRINGER INGELHEIM PHAMACEUTICALS, INC. (US) 2005-12-13 US claimed
EP-1513516-A1 SUBSTITUTED 3-AMINO-THIENO(2,3-b) PYRIDINE-2-CARBOXYLIC ACID AMIDE COMPOUNDS ANDPROCESSES FOR PREPARING AND THEIR USES BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2005-03-16 EP claimed
US-20040180922-A1 Substituted 3-amino-thieno [2,3-b]pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2004-09-16 US claimed
US-20040053957-A1 Substituted 3-amino-thieno [2,3-b]pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2004-03-18 US claimed
WO-2003103661-A1 SUBSTITUTED 3-AMINO-THIENO[2,3-b]PYRIDINE-2-CARBOXYLIC ACID AMIDE COMPOUNDS AND PROCESSES FOR PREPARING AND THEIR USES BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2003-12-18 WO claimed
US-5389602-A PLANT GROWTH REGULATORS BASF AKTIENGESELLSCHAFT (DE) 1995-02-14 US claimed
EP-0345635-B1 Herbicidal tetrahydropyran-2,4-diones BASF AG (DE) 1994-10-05 EP claimed
US-5166399-A SUBSTITUTED OXIME ETHERS AND FUNGICIDES WHICH CONTAIN THESE COMPOUNDS BASF AKTIENGESELLSCHAFT (DE) 1992-11-24 US claimed
EP-0121171-B1 FUNGICIDES, PROCESS FOR THEIR PREPARATION AND THEIR USE BAYER AG (DE) 1989-05-10 EP claimed
EP-0105166-B1 SUBSTITUTED TERT. BUTANOL DERIVATIVES, METHOD FOR THEIR PREPARATION AND ANTIMYCOTIC AGENTS CONTAINING THEM BAYER AG (DE) 1987-04-22 EP claimed
CN-115536646-A Nematicidal active compound and preparation method and application thereof 华东理工大学 2022-12-30 CN disclosed
EP-2008654-A1 3-amino-thieno[2,3-b]pyridine-2-carboxylic acid amides Boehringer Ingelheim Pharmaceuticals, Inc. (US) 2008-12-31 EP disclosed
EP-1513516-B1 SUBSTITUTED 3-AMINO-THIENO(2,3-b) PYRIDINE-2-CARBOXYLIC ACID AMIDE COMPOUNDS AND PROCESSES FOR PREPARING AND THEIR USES BOEHRINGER INGELHEIM PHARMA (US) 2008-12-03 EP disclosed
US-4740516-A Substituted t-butanol fungicidal agents BAYER AKTIENGESELLSCHAFT (DE) 1988-04-26 US disclosed
US-4621095-A BIS-AZOLYL-SUBSTITUTED TERT-BUTANOL DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 1986-11-04 US disclosed
US-4618619-A Substituted t-butanol fungicidal agents BAYER AKTIENGESELLSCHAFT (DE) 1986-10-21 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 (3 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-20040053957-A1 Substituted 3-amino-thieno [2,3-b]pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses NFKBIA, IKBKB, CHUK IKBKB 2/4885CHUK 3/4885EPHA3 4274/4885
US-20050288285-A1 Substituted 3-amino-thieno[2,3-b]pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses NFKBIA, CHUK, IKBKB IKBKB 3/4885CHUK 2/4885EPHA3 4318/4885
US-20040180922-A1 Substituted 3-amino-thieno [2,3-b]pyridine-2-carboxylic acid amide compounds and processes for preparing and their uses NFKBIA, IKBKB, CHUK IKBKB 2/4885CHUK 3/4885EPHA3 4274/4885

“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.