SCHEMBL8713790

SCHEMBL8713790

COc1ccccc1C(C)(Cc1ccccc1Cl)C[C@H](N)O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 6/20 0.47
NR3C2 P08235 6/20 0.47
PGR P06401 2/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 1/20 0.37
CASR P41180 2/20 0.35
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
IDO1 P14902 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34

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
SCHEMBL8719259 0.90 NR3C1 (0.39) NR3C1NR3C2PGRMEN1KMT2A
SCHEMBL8716180 0.90 IDO1 (0.41) NR3C1NR3C2MEN1KMT2AMAPT
SCHEMBL8713910 0.87 SLC6A2 (0.41) NR3C1NR3C2SLC6A2SLC6A4SLC6A3
SCHEMBL8714179 0.86 NR3C1 (0.46) NR3C1NR3C2PGRMEN1KMT2A
SCHEMBL8713610 0.85 LMNA (0.43) NR3C1NR3C2PGRCASRIDO1
SCHEMBL8716231 0.85 RXRA (0.41) MEN1KMT2AMAPT
SCHEMBL8718570 0.83 SLC6A2 (0.38) NR3C1NR3C2SLC6A2SLC6A4SLC6A3
SCHEMBL8714242 0.83 SLC6A2 (0.38) NR3C1NR3C2MEN1KMT2ASLC6A2
SCHEMBL8716208 0.83 SLC6A2 (0.38) NR3C1NR3C2SLC6A2SLC6A4SLC6A3
SCHEMBL8720320 0.81 NR3C1 (0.41) NR3C1NR3C2MEN1KMT2AMAPT

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
US-5811293-A CULTURE PRODUCT AS CHEMICAL INTERMEDIATE FOR ANTI-OBESITY AGENT DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 1998-09-22 US disclosed