SCHEMBL6984121

SCHEMBL6984121

CCCc1cccc(C(C)C)c1N1C(=O)c2cccc3c(OCO)ccc(c23)C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ANPEP P15144 5/20 0.41
▸ DPP4 P27487 5/20 0.41
▸ KMT2A Q03164 4/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ PABPC1 P11940 1/20 0.40
▸ XBP1 P17861 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ SMARCA2 P51531 1/20 0.40
▸ NFKB2 Q00653 1/20 0.40
▸ RELA Q04206 1/20 0.40
▸ PRMT1 Q99873 1/20 0.39
▸ NR1H2 P55055 1/20 0.38
▸ NR1H3 Q13133 1/20 0.38
▸ MEN1 O00255 2/20 0.36
▸ USP2 O75604 1/20 0.36

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
SCHEMBL6991960 0.90 ANPEP (0.50) ANPEPDPP4KMT2AALDH1A1LMNA
SCHEMBL14500358 0.84 ANPEP (0.49) ANPEPDPP4KMT2AALDH1A1LMNA
SCHEMBL1517978 0.82 ANPEP (0.48) ANPEPDPP4KMT2AALDH1A1LMNA
SCHEMBL1517966 0.81 ANPEP (0.47) ANPEPDPP4KMT2AALDH1A1LMNA
SCHEMBL12414747 0.81 ANPEP (0.38) ANPEPDPP4KMT2AALDH1A1LMNA
SCHEMBL1517955 0.80 ANPEP (0.46) ANPEPDPP4KMT2AALDH1A1LMNA
SCHEMBL12414748 0.79 ANPEP (0.37) ANPEPDPP4KMT2AALDH1A1LMNA
SCHEMBL6986876 0.79 MCL1 (0.39) ANPEPDPP4KMT2AALDH1A1LMNA
SCHEMBL13288152 0.76 ANPEP (0.44) ANPEPDPP4KMT2AALDH1A1LMNA
SCHEMBL12414732 0.75 ANPEP (0.39) ANPEPDPP4NR1H2NR1H3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8507590-B2 Fluorescent brighteners, methods of preparation thereof, fluorescent brightener compositions, and methods of preparation and uses thereof SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2013-08-13 — — US disclosed
US-20120203001-A1 FLUORESCENT BRIGHTENERS, METHODS OF PREPARATION THEREOF, FLUORESCENT BRIGHTENER COMPOSITIONS, AND METHODS OF PREPARATION AND USES THEREOF SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2012-08-09 — — US disclosed
US-8183310-B2 Fluorescent brighteners, methods of preparation thereof, fluorescent brightener compositions, and methods of preparation and uses thereof SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2012-05-22 — — US disclosed
US-20110065843-A1 FLUORESCENT BRIGHTENERS, METHODS OF PREPARATION THEREOF, FLUORESCENT BRIGHTENER COMPOSITIONS, AND METHODS OF PREPARATION AND USES THEREOF SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2011-03-17 — — 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-20110065843-A1 FLUORESCENT BRIGHTENERS, METHODS OF PREPARATION THEREOF, FLUORESCENT BRIGHTENER COMPOSITIONS, AND METHODS OF PREPARATION AND USES THEREOF C1R, C1S, C9 ANPEP 2771/4885DPP4 4467/4885KMT2A 3088/4885
US-20120203001-A1 FLUORESCENT BRIGHTENERS, METHODS OF PREPARATION THEREOF, FLUORESCENT BRIGHTENER COMPOSITIONS, AND METHODS OF PREPARATION AND USES THEREOF C1R, C1S, C9 ANPEP 2771/4885DPP4 4467/4885KMT2A 3088/4885

“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.

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