SCHEMBL5191970

SCHEMBL5191970

COc1ccc(NC(=O)N2CCN(C(C)Oc3ccc(C)cc3)C(CC(N)=O)C2)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
SMN1; SMN2 Q16637 3/20 0.44
KMT2A Q03164 3/20 0.43
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA9 Q16790 2/20 0.43
PTPN7 P35236 1/20 0.43
BLM P54132 1/20 0.43
TSHR P16473 1/20 0.42
MEN1 O00255 1/20 0.41
PKM P14618 1/20 0.41
CCR2 P41597 1/20 0.41
POLB P06746 2/20 0.41
TAS1R3 Q7RTX0 1/20 0.40
TAS1R1 Q7RTX1 1/20 0.40
TAS1R2 Q8TE23 1/20 0.40
GFER P55789 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL5199484 0.81 MAPT (0.51) MAPTSMN1; SMN2KMT2ABLMTSHR
SCHEMBL5193973 0.80 MAPT (0.47) MAPTSMN1; SMN2KMT2ABLMMEN1
SCHEMBL5190772 0.77 OGA (0.46) MAPTSMN1; SMN2KMT2ABLMTSHR
SCHEMBL5193442 0.77 MAPT (0.55) MAPTSMN1; SMN2KMT2ACA12CA1
SCHEMBL5190603 0.73 FFAR1 (0.42) SMN1; SMN2KMT2ATSHRMEN1POLB
SCHEMBL5194086 0.72 FAAH (0.62) MAPTSMN1; SMN2KMT2AMEN1
SCHEMBL5193199 0.71 MAPT (0.55) MAPTSMN1; SMN2KMT2ABLMTSHR
SCHEMBL5210351 0.70 FAAH (0.46) MAPTKMT2AMEN1CCR2LMNA
SCHEMBL28869329 0.69 MAPT (1.00) MAPTSMN1; SMN2KMT2ACA12CA1
SCHEMBL5193490 0.69 FAAH (0.50) MAPT

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-0968206-B8 N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS BERLEX INC (US) 2007-01-24 EP disclosed
EP-0968206-A1 N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS BERLEX LABORATORIES, INC. (US) 2000-01-05 EP disclosed
WO-1998037079-A1 N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS BERLEX LABORATORIES, INC. (US) 1998-08-27 WO disclosed