SCHEMBL8932716

SCHEMBL8932716

COn1c(C=O)cc2cc(C(O)c3ccccc3)ccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
NR3C1 P04150 1/20 0.32
PPARG P37231 1/20 0.32
MAOA P21397 2/20 0.32
TSHR P16473 2/20 0.32
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31
SRD5A2 P31213 1/20 0.31
ASAH1 Q13510 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
PTGS2 P35354 3/20 0.31
PTGS1 P23219 2/20 0.31

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
SCHEMBL2592356 0.76 SMN1; SMN2 (0.46) KMT2ASMN1; SMN2GAAMAOACYP1A2
SCHEMBL9663458 0.71 PPARG (0.39) KMT2ALMNASMN1; SMN2GAAHTT
SCHEMBL9664286 0.69 RAB9A (0.52) CNR2KMT2ALMNASMN1; SMN2GAA
SCHEMBL9663713 0.68 RAB9A (0.45) KMT2ALMNASMN1; SMN2GAAHTT
SCHEMBL9663634 0.67 RAB9A (0.62) KMT2ALMNASMN1; SMN2GAAHTT
SCHEMBL3284398 0.65 AKR1C3 (0.57) LMNATSHRPTGS2PTGS1AKR1C3
Diphenylmethanol SCHEMBL27594793 0.65 SMN1; SMN2 (0.48) KMT2ALMNASMN1; SMN2CA12CA1
Diphenylmethanol SCHEMBL11867320 0.64 SMN1; SMN2 (0.52) CNR2KMT2ALMNASMN1; SMN2CA12
SCHEMBL8869444 0.64 LMNA (0.39) KMT2ALMNASMN1; SMN2HTTNR3C1
SCHEMBL477559 0.63 UGT2B7 (0.61) KMT2ATSHRCYP1A2

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
WO-1996026207-A1 THIAZOLIDINE AND OXAZOLIDINE INDOLES WITH HYPOCLYCEMIC ACTIVITY NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1996-08-29 WO disclosed