SCHEMBL7435440

SCHEMBL7435440

Cn1c(Cl)nc2nc(-c3ccccc3)n(Cc3ccccc3)c2c1=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.57
ALDH1A1 P00352 7/20 0.51
LMNA P02545 4/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
RECQL P46063 1/20 0.51
RAB9A P51151 1/20 0.51
KDM4E B2RXH2 1/20 0.48
PDE6D O43924 1/20 0.48
ALDH2 P05091 1/20 0.48
ALDH3A1 P30838 1/20 0.48
BRD4 O60885 3/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CASR P41180 1/20 0.46
NPSR1 Q6W5P4 1/20 0.45
MAPK1 P28482 1/20 0.44
TP53 P04637 1/20 0.44
CFTR P13569 1/20 0.44
BCL2 P10415 1/20 0.44
MCL1 Q07820 1/20 0.44

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
SCHEMBL7437020 0.87 HPGD (0.50) HPGDALDH1A1LMNASMN1; SMN2KDM4E
SCHEMBL15691477 0.85 PDE2A (0.50) HPGDALDH1A1LMNASMN1; SMN2RECQL
SCHEMBL7445337 0.82 ALOX15 (0.47) HPGDALDH1A1LMNASMN1; SMN2RECQL
SCHEMBL7447211 0.80 HPGD (0.44) HPGDALDH1A1LMNASMN1; SMN2RECQL
SCHEMBL7441558 0.76 KDM4E (0.56) HPGDALDH1A1LMNASMN1; SMN2RECQL
SCHEMBL1723787 0.76 TLR7 (0.46) BRD4
SCHEMBL7449928 0.74 TSHR (0.46) HPGDALDH1A1LMNASMN1; SMN2RECQL
SCHEMBL7449932 0.74 TSHR (0.46) HPGDALDH1A1LMNASMN1; SMN2RECQL
SCHEMBL7446937 0.74 TSHR (0.44) HPGDALDH1A1LMNASMN1; SMN2RECQL
SCHEMBL7446930 0.74 TSHR (0.44) HPGDALDH1A1LMNASMN1; SMN2RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0538332-B1 POLYCYCLIC GUANINE DERIVATIVES SCHERING CORP (US) 1997-07-23 EP disclosed
US-5393755-A Hypotensive agents, enzyme inhibitors SCHERING CORPORATION (US) 1995-02-28 US disclosed
WO-1991019717-A1 POLYCYCLIC GUANINE DERIVATIVES SCHERING CORPORATION (US) 1991-12-26 WO disclosed