SCHEMBL8928876

SCHEMBL8928876

Cc1sc2c(c1C)C(c1ccccc1)=NCc1nnc(CNC(=O)c3cc4ccccc4n3CC(=O)O)n1-2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CCKAR P32238 1/20 0.37
HPGD P15428 1/20 0.35
RECQL P46063 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
BRD4 O60885 6/20 0.35
BRD2 P25440 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
F10 P00742 6/20 0.34
LMNA P02545 2/20 0.34
NTRK1 P04629 1/20 0.34
NTRK3 Q16288 1/20 0.34
TSHR P16473 1/20 0.34
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HTT P42858 1/20 0.33

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
SCHEMBL8928429 0.92 MEN1 (0.35) MEN1KMT2AHPGDRECQLSMN1; SMN2
SCHEMBL8928678 0.87 MEN1 (0.39) MEN1KMT2ACCKARHPGDRECQL
SCHEMBL8928748 0.84 OPRK1 (0.42) MEN1KMT2ACCKARHPGDRECQL
SCHEMBL8928637 0.84 MEN1 (0.42) MEN1KMT2ACCKARHPGDRECQL
SCHEMBL8928869 0.83 L3MBTL1 (0.36) MEN1KMT2ACCKARBRD4BRD2
SCHEMBL8928636 0.81 MIF (0.44) BRD4
SCHEMBL8928672 0.80 OPRK1 (0.43) MEN1KMT2ACCKARHPGDRECQL
SCHEMBL8928561 0.80 RECQL (0.38) MEN1KMT2ACCKARHPGDRECQL
SCHEMBL8928404 0.79 HPGD (0.41) HPGDRECQLSMN1; SMN2BRD4BRD2
SCHEMBL8928766 0.79 OPRK1 (0.42) MEN1KMT2ACCKARHPGDRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0776892-A1 THIENYLAZOLE COMPOUND AND THIENOTRIAZOLODIAZEPINE COMPOUND YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-06-04 EP disclosed