SCHEMBL8928569

SCHEMBL8928569

CCc1cc2c(s1)-n1c(nnc1CNC(=O)c1ccc(Cl)c(Cl)c1)CN=C2c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 3/20 0.51
PDE4D Q08499 1/20 0.51
RECQL P46063 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HPGD P15428 3/20 0.44
PTAFR P25105 11/20 0.41
CYP3A4 P08684 1/20 0.41
ALOX15 P16050 1/20 0.41
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
BRD4 O60885 1/20 0.37
LMNA P02545 1/20 0.37
GABRA1 P14867 1/20 0.37
CNR1 P21554 1/20 0.37
GABRA5 P31644 1/20 0.37
GABRA3 P34903 1/20 0.37
GABRA2 P47869 1/20 0.37
GABRB2 P47870 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
SCHEMBL8928716 0.94 OPRK1 (0.47) OPRK1PDE4DRECQLSMN1; SMN2HPGD
SCHEMBL8928475 0.93 OPRK1 (0.61) OPRK1PDE4DPTAFRCYP3A4ALOX15
SCHEMBL8928371 0.90 HPGD (0.45) OPRK1PDE4DRECQLSMN1; SMN2HPGD
SCHEMBL8928554 0.87 OPRK1 (0.53) OPRK1PDE4DPTAFRCYP3A4ALOX15
SCHEMBL8928535 0.86 OPRK1 (0.49) OPRK1PDE4DPTAFRCYP3A4ALOX15
SCHEMBL8928589 0.85 OPRK1 (0.62) OPRK1PDE4DPTAFRCYP3A4ALOX15
SCHEMBL8928488 0.85 HPGD (0.44) OPRK1RECQLSMN1; SMN2HPGDKDM4E
SCHEMBL8928595 0.85 OPRK1 (0.62) OPRK1PDE4DPTAFRCYP3A4ALOX15
SCHEMBL8928420 0.85 OPRK1 (0.59) OPRK1PDE4DPTAFRCYP3A4ALOX15
SCHEMBL8928582 0.85 OPRK1 (0.59) OPRK1PDE4DPTAFRCYP3A4ALOX15

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