SCHEMBL2926787

SCHEMBL2926787

COc1cc(C(=O)NCc2cccnc2)cc(OC)c1OC

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.78
L3MBTL1 Q9Y468 3/20 0.78
USP2 O75604 1/20 0.78
NPSR1 Q6W5P4 1/20 0.78
CYP1A2 P05177 2/20 0.71
CYP3A4 P08684 2/20 0.71
TSHR P16473 2/20 0.71
BLM P54132 1/20 0.71
CYP2C19 P33261 1/20 0.69
RECQL P46063 1/20 0.68
GAA P10253 2/20 0.67
HPGD P15428 2/20 0.67
POLB P06746 2/20 0.67
KDM4E B2RXH2 1/20 0.67
KMT2A Q03164 1/20 0.64
ROCK2 O75116 1/20 0.64
ROCK1 Q13464 1/20 0.64
LMNA P02545 3/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
MAPT P10636 1/20 0.58

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
SCHEMBL13947063 0.85 ALDH1A1 (0.82) ALDH1A1L3MBTL1USP2NPSR1CYP1A2
SCHEMBL12426371 0.84 ALDH1A1 (0.80) ALDH1A1L3MBTL1USP2NPSR1CYP1A2
SCHEMBL2919972 0.84 SMN1; SMN2 (0.82) ALDH1A1L3MBTL1CYP2C19HPGDKDM4E
Picotamide SCHEMBL30206880 0.83 CYP1A2 (1.00) ALDH1A1L3MBTL1USP2NPSR1CYP1A2
Picotamide SCHEMBL30254057 0.83 CYP1A2 (1.00) ALDH1A1L3MBTL1USP2NPSR1CYP1A2
Picotamide SCHEMBL137025 0.83 CYP1A2 (1.00) ALDH1A1L3MBTL1USP2NPSR1CYP1A2
SCHEMBL11629761 0.82 ALDH1A1 (0.59) ALDH1A1L3MBTL1USP2NPSR1CYP2C19
SCHEMBL14082524 0.82 L3MBTL1 (0.60) ALDH1A1L3MBTL1USP2NPSR1CYP1A2
SCHEMBL21246573 0.82 ALDH1A1 (0.80) ALDH1A1L3MBTL1USP2NPSR1CYP1A2
Picotamide SCHEMBL4877561 0.82 CYP1A2 (0.98) ALDH1A1L3MBTL1USP2NPSR1CYP1A2

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 5 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-7465739-B2 Compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2008-12-16 US disclosed
US-20050176742-A1 Novel compounds and their use in therapy SOLVAY PHARMACEUTICALS B.V. (NL) 2005-08-11 US 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 ALDH1A1 229/4885L3MBTL1 3522/4885USP2 1772/4885
US-20050038053-A1 Novel compounds and their use in therapy HSD17B11, HSD17B2, HSD17B1 ALDH1A1 229/4885L3MBTL1 3522/4885USP2 1772/4885

“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.