SCHEMBL8928561

SCHEMBL8928561

CCOC(=O)Cn1c(C(=O)NCc2nnc3n2-c2sc(C)cc2C(c2ccccc2)=NC3)cc2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HPGD P15428 2/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
PTAFR P25105 6/20 0.35
HTT P42858 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HSD17B10 Q99714 1/20 0.33
OPRK1 P41145 2/20 0.33
ALDH1A1 P00352 1/20 0.33
PDE4D Q08499 1/20 0.33
CCKAR P32238 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
CYP3A4 P08684 1/20 0.32
ALOX15 P16050 1/20 0.32
NTRK1 P04629 1/20 0.32
NTRK3 Q16288 1/20 0.32

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
SCHEMBL8928766 0.93 OPRK1 (0.42) RECQLSMN1; SMN2HPGDMEN1KMT2A
SCHEMBL8928678 0.92 MEN1 (0.39) RECQLSMN1; SMN2HPGDMEN1KMT2A
SCHEMBL8928710 0.90 RECQL (0.38) RECQLSMN1; SMN2HPGDMEN1KMT2A
SCHEMBL8928429 0.88 MEN1 (0.35) RECQLSMN1; SMN2HPGDMEN1KMT2A
SCHEMBL8928579 0.88 OPRK1 (0.43) RECQLSMN1; SMN2HPGDMEN1KMT2A
SCHEMBL8928402 0.85 OPRK1 (0.53) MEN1KMT2APTAFROPRK1PDE4D
SCHEMBL8928748 0.85 OPRK1 (0.42) RECQLSMN1; SMN2HPGDMEN1KMT2A
SCHEMBL8928672 0.81 OPRK1 (0.43) RECQLSMN1; SMN2HPGDMEN1KMT2A
SCHEMBL8928637 0.80 MEN1 (0.42) RECQLSMN1; SMN2HPGDMEN1KMT2A
SCHEMBL8928876 0.80 MEN1 (0.37) RECQLSMN1; SMN2HPGDMEN1KMT2A

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