SCHEMBL6562362

SCHEMBL6562362

CC1(C)CC(O)c2cc(N)ccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.41
DRD1 P21728 1/20 0.33
CHEK1 O14757 1/20 0.33
AURKA O14965 1/20 0.33
DAPK3 O43293 1/20 0.33
JAK2 O60674 1/20 0.33
PRKD3 O94806 1/20 0.33
MAP4K4 O95819 1/20 0.33
PAK4 O96013 1/20 0.33
ABL1 P00519 1/20 0.33
NTRK1 P04629 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
CSF1R P07333 1/20 0.33
RET P07949 1/20 0.33
IGF1R P08069 1/20 0.33
MET P08581 1/20 0.33
PDGFRB P09619 1/20 0.33
PIM1 P11309 1/20 0.33
FGFR1 P11362 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
SCHEMBL29859799 0.80 CA12 (0.41) PGRDRD1CHEK1AURKADAPK3
SCHEMBL23501557 0.80 CA12 (0.41) PGRDRD1CHEK1AURKADAPK3
SCHEMBL26649923 0.79 USP2 (0.42) PGRTSHR
SCHEMBL10511630 0.79 PGR (0.41) PGRTSHR
SCHEMBL7517009 0.76 CYP19A1 (0.41) DRD1CHEK1AURKADAPK3JAK2
SCHEMBL9158928 0.75 PGR (0.53) PGRCHRNB2CHRNA4
SCHEMBL9156355 0.73 HIF1A (0.46) TSHR
SCHEMBL6561051 0.73 CA2 (0.38) PGRCA2TSHR
SCHEMBL14101425 0.73 PGR (0.44) PGRNTRK1TSHR
SCHEMBL1508195 0.73 PGR (0.44) PGRNTRK1TSHR

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-1085009-B1 INDAN DERIVATIVES NISSAN CHEMICAL IND LTD (JP) 2004-11-10 EP disclosed
US-6486178-B1 Indane derivatives NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2002-11-26 US disclosed
EP-1085009-A1 INDAN DERIVATIVES Nissan Chemical Industries, Ltd. (JP) 2001-03-21 EP disclosed