SCHEMBL5473245

SCHEMBL5473245

COc1cc2c(C)cc(=O)[nH]c2cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 6/20 0.54
CYP19A1 P11511 4/20 0.54
KDM4E B2RXH2 4/20 0.53
SMN1; SMN2 Q16637 2/20 0.51
TP53 P04637 1/20 0.51
LMNA P02545 1/20 0.51
TNKS2 Q9H2K2 4/20 0.50
MTNR1A P48039 1/20 0.47
MTNR1B P49286 1/20 0.47
MAPT P10636 2/20 0.45
PDE3B Q13370 1/20 0.45
PDE3A Q14432 1/20 0.45
BLM P54132 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43

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
SCHEMBL19146396 0.86 NQO2 (0.60) NQO2CYP19A1KDM4ESMN1; SMN2TP53
SCHEMBL14492311 0.80 KDM4E (0.58) KDM4ELMNAMTNR1AMTNR1BMAPT
SCHEMBL12047270 0.80 NQO2 (0.54) NQO2CYP19A1KDM4ESMN1; SMN2TP53
SCHEMBL8700898 0.80 NQO2 (0.54) NQO2CYP19A1KDM4ESMN1; SMN2TP53
SCHEMBL28314220 0.79 KDM4E (0.54) NQO2CYP19A1KDM4ESMN1; SMN2MAPT
SCHEMBL30081022 0.79 KDM4E (0.54) NQO2CYP19A1KDM4ESMN1; SMN2MAPT
SCHEMBL14492310 0.78 KDM4E (0.57) KDM4ESMN1; SMN2LMNAMTNR1AMTNR1B
SCHEMBL26607699 0.77 KDM4E (0.53) NQO2CYP19A1KDM4ESMN1; SMN2TP53
SCHEMBL16896940 0.77 GRIN2D (0.57) NQO2CYP19A1KDM4ESMN1; SMN2TP53
SCHEMBL11613029 0.76 MTNR1A (0.50) KDM4ESMN1; SMN2LMNAMTNR1AMTNR1B

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
US-20070149560-A1 Novel fused triazolones and the uses thereof ASTRAZENECA AB (SE) 2007-06-28 US disclosed
US-20070149560-A1 Novel fused triazolones and the uses thereof ASTRAZENECA AB (SE) 2007-06-28 US disclosed
US-20070149560-A1 Novel fused triazolones and the uses thereof ASTRAZENECA AB (SE) 2007-06-28 US disclosed
EP-1613625-A1 NOVEL FUSED TRIAZOLONES AND THE USES THEREOF AstraZeneca AB (SE) 2006-01-11 EP disclosed
WO-2004081008-A1 NOVEL FUSED TRIAZOLONES AND THE USES THEREOF ASTRAZENECA AB (SE) 2004-09-23 WO 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 (1 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-20070149560-A1 Novel fused triazolones and the uses thereof TP53, BRCA1, KLK3 NQO2 974/4885CYP19A1 46/4885KDM4E 3368/4885

“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.