SCHEMBL4358008

SCHEMBL4358008

COC(=O)CCc1cc(C(=O)c2c(Cl)c(Cl)c(Cl)c(Cl)c2C(=O)O)c(O)c(F)c1O

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL4361731 0.90 L3MBTL1 (0.32) ALDH1A1MAPK1L3MBTL1
SCHEMBL4013710 0.87 ALDH1A1 (0.38) ALDH1A1MAPK1
SCHEMBL4016928 0.85 ALDH1A1 (0.32) ALDH1A1MAPK1
SCHEMBL4011884 0.84 ALDH1A1 (0.36) ALDH1A1MAPK1L3MBTL1
SCHEMBL4358116 0.83 L3MBTL1 (0.33) ALDH1A1MAPK1L3MBTL1
SCHEMBL4012367 0.83 ACLY (0.35) ALDH1A1MAPK1
SCHEMBL14458606 0.82
SCHEMBL4018520 0.81 KMT2A (0.41) ALDH1A1MAPK1L3MBTL1
SCHEMBL4358865 0.81 ALDH1A1 (0.36) ALDH1A1MAPK1L3MBTL1
SCHEMBL4363671 0.78 DPP4 (0.37) ALDH1A1MAPK1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8569516-B2 Compounds and methods for fluorescent labeling ELITECH HOLDING B.V. (NL) 2013-10-29 US disclosed
US-7601851-B2 Compounds and methods for fluorescent labeling EPOCH BIOSCIENCES, INC. (US) 2009-10-13 US disclosed
US-7112684-B2 Compounds and methods for fluorescent labeling EPOCH BIOSCIENCES, INC. (US) 2006-09-26 US disclosed
US-20060204990-A1 Compounds and methods for fluorescent labeling EPOCH BIOSCIENCES, INC. (US) 2006-09-14 US disclosed
US-20050277144-A1 Compounds and methods for fluorescent labeling EPOCH BIOSCIENCES, INC. (US) 2005-12-15 US disclosed
US-6972339-B2 Compounds and methods for fluorescent labeling EPOCH BIOSCIENCES, INC. (US) 2005-12-06 US disclosed
US-20050176066-A1 Compounds and methods for fluorescent labeling EPOCH BIOSCIENCES, INC. (US) 2005-08-11 US disclosed
US-20050171340-A1 COMPOUNDS AND METHODS FOR FLUORESCENT LABELING EPOCH BIOSCIENCES, INC. (US) 2005-08-04 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 (4 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-20050176066-A1 Compounds and methods for fluorescent labeling HLCS, GLB1, TUBB ALDH1A1 218/4885MAPK1 4791/4885L3MBTL1 692/4885
US-20060204990-A1 Compounds and methods for fluorescent labeling GLB1, HLCS, PFAS ALDH1A1 445/4885MAPK1 4800/4885L3MBTL1 367/4885
US-20050171340-A1 COMPOUNDS AND METHODS FOR FLUORESCENT LABELING HLCS, GLB1, TUBB ALDH1A1 218/4885MAPK1 4791/4885L3MBTL1 692/4885
US-20050277144-A1 Compounds and methods for fluorescent labeling HLCS, GLB1, TUBB ALDH1A1 218/4885MAPK1 4791/4885L3MBTL1 692/4885

“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.