SCHEMBL9707250

SCHEMBL9707250

COC(=O)Oc1ccc2[nH]nnc2c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.35
PDGFRA P16234 2/20 0.35
NPC1 O15118 3/20 0.35
MAPT P10636 3/20 0.35
RAB9A P51151 3/20 0.35
LMNA P02545 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ALPL P05186 2/20 0.35
PDE3B Q13370 2/20 0.35
PDE3A Q14432 2/20 0.35
XDH P47989 2/20 0.34
MTNR1A P48039 1/20 0.34
MTNR1B P49286 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
DYRK1A Q13627 1/20 0.33
USP2 O75604 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL9027226 0.88 PDE3B (0.37) NPC1MAPTRAB9ALMNASMN1; SMN2
SCHEMBL27901873 0.84 PDGFRB (0.46) PDGFRBPDGFRAMAPTLMNAPDE3B
SCHEMBL20208508 0.83 CA1 (0.45) PDGFRBPDGFRAMAPTSMN1; SMN2ALDH1A1
SCHEMBL147112 0.83 PDGFRB (0.35) PDGFRBPDGFRAALPLPDE3BPDE3A
SCHEMBL8599616 0.81 MEN1 (0.46) PDGFRBPDGFRAMAPTPDE3BPDE3A
SCHEMBL30159393 0.81 PDGFRB (0.49) PDGFRBPDGFRANPC1MAPTRAB9A
SCHEMBL20260273 0.80 KMT2A (0.42) PDGFRBPDGFRAMAPTLMNASMN1; SMN2
SCHEMBL20260490 0.80 PDGFRB (0.43) PDGFRBPDGFRAMAPTMEN1KMT2A
SCHEMBL30159185 0.79 THRB (0.39) PDGFRBPDGFRAFGFR1
SCHEMBL204478 0.79 MEN1 (0.47) PDGFRBPDGFRANPC1MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992022536-A1 VINYLIMIDAZOLES, VINYLTRIAZOLES AND VINYLTETRAZOLES WITH A BICYCLIC SUBSTITUENT GROUP SCHERING AKTIENGESELLSCHAFT, BERLIN UND BERGKAMEN (DE) 1992-12-23 WO disclosed
EP-0518457-A1 Bicyclic substituted vinylimidazoles, -triazoles and -tetrazoles SCHERING AKTIENGESELLSCHAFT (DE) 1992-12-16 EP disclosed