SCHEMBL2925167

SCHEMBL2925167

CCC(C)Cn1c(-c2cc(OC)c(OC)c(OC)c2)nc2sc3c(c2c1=O)CCCC3

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDKN1A P38936 3/20 0.54
PTGS2 P35354 2/20 0.47
ALDH1A1 P00352 5/20 0.44
KDM4E B2RXH2 3/20 0.44
LMNA P02545 2/20 0.44
HPGD P15428 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
CASP3 P42574 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
SENP6 Q9GZR1 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 2/20 0.43
MIF P14174 1/20 0.42
THRB P10828 1/20 0.42
TP53 P04637 1/20 0.42
POLB P06746 3/20 0.42

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
SCHEMBL2920423 0.93 CDKN1A (0.57) CDKN1APTGS2ALDH1A1KDM4ELMNA
SCHEMBL2922595 0.88 CDKN1A (0.42) CDKN1APTGS2ALDH1A1KDM4ELMNA
SCHEMBL2925650 0.85 CDKN1A (0.56) CDKN1APTGS2ALDH1A1KDM4ELMNA
SCHEMBL2926345 0.84 CDKN1A (0.56) CDKN1APTGS2ALDH1A1KDM4ELMNA
SCHEMBL2924396 0.82 TP53 (0.58) CDKN1APTGS2ALDH1A1KDM4ELMNA
SCHEMBL2922001 0.81 MAPT (0.41) CDKN1AALDH1A1KDM4ELMNAHPGD
SCHEMBL2922685 0.81 CDKN1A (0.53) CDKN1APTGS2ALDH1A1KDM4ELMNA
SCHEMBL4068166 0.80 MAPT (0.55) CDKN1APTGS2ALDH1A1LMNAHPGD
SCHEMBL2923978 0.80 CDKN1A (0.44) CDKN1APTGS2ALDH1A1KDM4ELMNA
SCHEMBL2915153 0.79 NPC1 (0.60) CDKN1APTGS2ALDH1A1LMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1635839-B1 BENZO[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONES AND THEIR USE IN THERAPY ABBOTT HEALTHCARE PRODUCTS BV (NL) 2010-09-01 EP disclosed
US-7524853-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2009-04-28 US disclosed
US-7524853-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2009-04-28 US disclosed
US-7524853-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2009-04-28 US disclosed
US-7465739-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2008-12-16 US disclosed
US-7465739-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2008-12-16 US disclosed
US-7465739-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2008-12-16 US disclosed
EP-1635839-A2 BENZO[4,5]THIENO[2,3-D]PYRIMIDIN-4-ONES AND THEIR USE IN THERAPY Solvay Pharmaceuticals B.V. (NL) 2006-03-22 EP disclosed
US-20050176742-A1 Novel compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2005-08-11 US disclosed
WO-2005032527-A2 BENZO (4, 5) THIENO (2, 3-D) PYRIMIDIN-4-ONES AND THEIR USE IN THERAPY SOLVAY PHARMACEUTICALS B.V. (NL) 2005-04-14 WO disclosed
US-20050038053-A1 Novel compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2005-02-17 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-20050176742-A1 Novel compounds and their use in therapy HSD17B11, HSD17B2, HSD17B1 CDKN1A 849/4885PTGS2 773/4885ALDH1A1 229/4885
US-20050038053-A1 Novel compounds and their use in therapy HSD17B11, HSD17B2, HSD17B1 CDKN1A 849/4885PTGS2 773/4885ALDH1A1 229/4885

“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.