SCHEMBL7909264

SCHEMBL7909264

CCOC(=O)NC1Cc2ccccc2C1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.52
MTNR1A P48039 3/20 0.51
MTNR1B P49286 3/20 0.51
HRH3 Q9Y5N1 1/20 0.51
DRD2 P14416 1/20 0.51
MAPT P10636 1/20 0.50
GRM7 Q14831 3/20 0.49
NPC1 O15118 1/20 0.49
LMNA P02545 1/20 0.49
RAB9A P51151 1/20 0.49
NFKB1 P19838 1/20 0.49
NFKB2 Q00653 1/20 0.49
RELA Q04206 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
ACHE P22303 2/20 0.46
IDO1 P14902 1/20 0.46

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
Carbamic Acid SCHEMBL7763164 0.94 ATM (0.48) ATMMTNR1AMTNR1BHRH3DRD2
SCHEMBL3786131 0.90 MTNR1A (0.68) ATMMTNR1AMTNR1BDRD2MAPT
SCHEMBL10616615 0.86 ATM (0.45) ATMMTNR1AMTNR1BDRD2NFKB1
SCHEMBL8565940 0.83 EPHX2 (0.70) ATMMTNR1AMTNR1BDRD2MAPT
SCHEMBL8565942 0.83 EPHX2 (0.70) ATMMTNR1AMTNR1BDRD2MAPT
SCHEMBL6502466 0.82 MEN1 (0.55) MTNR1AMTNR1BHRH3MAPTGRM7
SCHEMBL170233 0.81 ALDH1A1 (0.65) MEN1KMT2ACA1CA2ACHE
SCHEMBL10615382 0.79 KDM4E (0.53) ATMDRD2NFKB1NFKB2RELA
SCHEMBL10616751 0.78 HPGD (0.44) ATMDRD2MAPTCA1CA2
SCHEMBL173219 0.78 EPHX2 (0.69) MTNR1AMTNR1BDRD2MAPTGRM7

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
US-6197798-B1 INHIBITORS OF MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN NOVARTIS AG (CH) 2001-03-06 US disclosed
US-5272157-A Derivatives of 4-(aminomethyl) piperidine, their preparation and their therapeutic application SYNTHELABO (FR) 1993-12-21 US disclosed
US-5179108-A Antiserotonin agents or cardiovascular disorders SYNTHELABO (FR) 1993-01-12 US disclosed