SCHEMBL2775932

SCHEMBL2775932

Cc1nc2ccc(OC3CCN(C(=O)[C@@H](NC(=O)c4nc5ccccc5nc4O)C(C)C)CC3)cc2s1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
CCR1 P32246 4/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
ALOX15 P16050 2/20 0.43
TP53 P04637 2/20 0.41
MAPT P10636 1/20 0.41
ACACB O00763 1/20 0.39
P2RY12 Q9H244 1/20 0.39
LMNA P02545 2/20 0.38
SRD5A1 P18405 1/20 0.37
ATM Q13315 1/20 0.37

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
SCHEMBL2776775 0.86 SMN1; SMN2 (0.52) KMT2ACCR1SMN1; SMN2ALOX15TP53
SCHEMBL12977746 0.85 LMNA (0.45) KMT2ACCR1P2RY12LMNASRD5A1
SCHEMBL2776482 0.85 CCR1 (0.46) KMT2ACCR1P2RY12LMNASRD5A1
SCHEMBL2776300 0.85 CCR1 (0.46) KMT2ACCR1P2RY12LMNAATM
SCHEMBL12846872 0.84 LMNA (0.44) KMT2ACCR1P2RY12LMNASRD5A1
SCHEMBL2774809 0.83 CCR1 (0.52) CCR1
SCHEMBL2774241 0.83 CCR1 (0.52) KMT2ACCR1LMNASRD5A1
SCHEMBL2774870 0.83 CCR1 (0.52) KMT2ACCR1LMNASRD5A1
SCHEMBL2775357 0.83 CCR1 (0.47) KMT2ACCR1P2RY12LMNA
SCHEMBL2776467 0.83 LMNA (0.42) KMT2ACCR1MAPTACACBP2RY12

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-20110053933-A1 HYDROXYQUINOXALINECARBOXAMIDE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-03-03 US disclosed
US-20110053933-A1 HYDROXYQUINOXALINECARBOXAMIDE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-03-03 US disclosed
US-20110053933-A1 HYDROXYQUINOXALINECARBOXAMIDE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-03-03 US disclosed
EP-2258697-A1 HYDROXYQUINOXALINECARBOXAMIDE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2010-12-08 EP 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-20110053933-A1 HYDROXYQUINOXALINECARBOXAMIDE DERIVATIVE F12, F2, C3AR1 KMT2A 291/4885CCR1 1428/4885SMN1; SMN2 4169/4885

“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.