SCHEMBL9077243

SCHEMBL9077243

O=C(O)C(OCc1ccccc1)c1cccc(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
LMNA P02545 1/20 0.45
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
SLC1A3 P43003 2/20 0.44
SLC1A2 P43004 2/20 0.44
SLC1A1 P43005 2/20 0.44
GRM5 P41594 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
ACP3 P15309 1/20 0.44
TACR1 P25103 2/20 0.44
RXRA P19793 2/20 0.43
RXRB P28702 2/20 0.43
RXRG P48443 2/20 0.43
HCAR2 Q8TDS4 1/20 0.43
CHRNB2 P17787 1/20 0.42

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
SCHEMBL10334664 0.88 SLC1A3 (0.46) MEN1KMT2APPARGPPARASLC1A3
SCHEMBL15610228 0.85 KYNU (0.50) MEN1KMT2ALMNASLC1A3SLC1A2
SCHEMBL1586340 0.84 SLC1A3 (0.54) MEN1KMT2ALMNASLC1A3SLC1A2
SCHEMBL9291604 0.83 SLC6A2 (0.50) MEN1KMT2APPARGPPARASLC1A3
SCHEMBL2537007 0.82 MAOB (0.46) MEN1KMT2ASLC1A3SLC1A2SLC1A1
SCHEMBL6360902 0.80 PPIA (0.47) MEN1KMT2ALMNA
SCHEMBL8009506 0.80 MTNR1A (0.55) KMT2A
SCHEMBL11227027 0.79 PPARA (0.57) MEN1KMT2APPARGPPARACYP1A2
SCHEMBL5089141 0.79 FFAR1 (0.48) MEN1KMT2ALMNASLC1A3SLC1A2
SCHEMBL15610225 0.79 KYNU (0.43) MEN1KMT2ASLC1A3SLC1A2SLC1A1

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-5495046-A PSYCHOLOGICAL DISORDERS TAISHO PHARMACEUTICAL CO., LTD. (JP) 1996-02-27 US disclosed
EP-0641766-A1 ALKOXYPHENYLALKYLAMINE DERIVATIVE TAISHO PHARMACEUTICAL CO. LTD (JP) 1995-03-08 EP disclosed
US-4964893-A REDUCING INJURY TO A CROP PLANT MONSANTO COMPANY (US) 1990-10-23 US disclosed