SCHEMBL7379752

SCHEMBL7379752

CCOC(=O)C(C)Nc1ccc(F)c(Cl)c1

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.54
KDM4E B2RXH2 1/20 0.53
LMNA P02545 3/20 0.51
SMN1; SMN2 Q16637 6/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49
HTT P42858 3/20 0.49
MAPT P10636 3/20 0.46
SLC2A1 P11166 1/20 0.46
CASP3 P42574 1/20 0.45
SENP7 Q9BQF6 1/20 0.45

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
SCHEMBL7379755 1.00 TSHR (0.54) TSHRKDM4ELMNASMN1; SMN2MEN1
SCHEMBL4417689 0.87 HPGD (0.51) TSHRKDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL4415360 0.87 ALDH1A1 (0.51) TSHRLMNASMN1; SMN2MEN1KMT2A
SCHEMBL4267988 0.87 TSHR (0.54) TSHRKDM4ELMNASMN1; SMN2MEN1
SCHEMBL733757 0.87 ALDH1A1 (0.51) TSHRLMNASMN1; SMN2MEN1KMT2A
SCHEMBL4267985 0.87 TSHR (0.54) TSHRKDM4ELMNASMN1; SMN2MEN1
SCHEMBL4417687 0.87 HPGD (0.51) TSHRKDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL1877841 0.86 TSHR (0.51) TSHRKDM4ELMNASMN1; SMN2MEN1
SCHEMBL4276786 0.86 TSHR (0.51) TSHRKDM4ELMNASMN1; SMN2MEN1
SCHEMBL4276791 0.86 TSHR (0.51) TSHRKDM4ELMNASMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6399628-B1 ALZHEIMER'S DISEASE ATHENA NEUROSCIENCES, INC. 2002-06-04 US claimed
JP-2001508408-A 2001-06-26 JP claimed
EP-0944580-A2 N-(ARYL/HETEROARYL) AMINO ACID ESTERS, PHARMACEUTICAL COMPOSITIONS, AND METHODS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS Elan Pharmaceuticals, Inc. (US) 1999-09-29 EP claimed
WO-1998022441-A2 N-(ARYL/HETEROARYL) AMINO ACID ESTERS, PHARMACEUTICAL COMPOSITIONS, AND METHODS FOR INHIBITING BETA-AMYLOID PEPTIDE AND/OR ITS SYNTHESIS ELAN PHARMACEUTICALS, INC. (US) 1998-05-28 WO claimed
JP-60109504-A None JP disclosed
US-6399628-B1 ALZHEIMER'S DISEASE ATHENA NEUROSCIENCES, INC. 2002-06-04 US disclosed
US-5965614-A A PEPTIDE BLOCKING AGENT FOR TREATING ALZHEIMER'S DISEASE ATHENA NEUROSCIENCES, INC. 1999-10-12 US disclosed
EP-0944580-A2 N-(ARYL/HETEROARYL) AMINO ACID ESTERS, PHARMACEUTICAL COMPOSITIONS, AND METHODS FOR INHIBITING BETA-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS Elan Pharmaceuticals, Inc. (US) 1999-09-29 EP disclosed
WO-1998022441-A2 N-(ARYL/HETEROARYL) AMINO ACID ESTERS, PHARMACEUTICAL COMPOSITIONS, AND METHODS FOR INHIBITING BETA-AMYLOID PEPTIDE AND/OR ITS SYNTHESIS ELAN PHARMACEUTICALS, INC. (US) 1998-05-28 WO disclosed
US-4619685-A N-SUBSTITUTED ALANINE DERIVATIVE NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 1986-10-28 US disclosed
JP-S60109504-A PLANT GROWTH REGULATING AGENT NISSAN CHEM IND LTD 1985-06-15 JP disclosed