SCHEMBL5213624

SCHEMBL5213624

O=C(CO)N1CCN(c2cc[c]cc2F)CC1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.49
MEN1 O00255 5/20 0.49
MAPT P10636 4/20 0.49
TSHR P16473 3/20 0.49
LMNA P02545 3/20 0.49
AKR1C3 P42330 1/20 0.43
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
ALDH1A1 P00352 2/20 0.42
POLB P06746 2/20 0.42
GRM5 P41594 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALOX15 P16050 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 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
SCHEMBL188445 0.87 KMT2A (0.46) KMT2AMEN1MAPTTSHRLMNA
SCHEMBL25220513 0.82 ALDH1A1 (0.47) KMT2AMEN1MAPTTSHRLMNA
SCHEMBL1903391 0.77 GRM5 (0.65) KMT2AMEN1MAPTTSHRLMNA
SCHEMBL4688294 0.76 NPSR1 (0.51) KMT2AMEN1MAPTTSHRLMNA
SCHEMBL188791 0.75 AKR1C3 (0.60) KMT2AMEN1MAPTLMNAAKR1C3
SCHEMBL1901740 0.74 ALDH1A1 (0.43) KMT2AMEN1MAPTTSHRNPC1
SCHEMBL188725 0.73 ALDH1A1 (0.44) MAPTLMNASMN1; SMN2ALDH1A1POLB
SCHEMBL1899800 0.73 ALDH1A1 (0.42) KMT2AMEN1MAPTTSHRLMNA
SCHEMBL1899796 0.73 ALDH1A1 (0.42) KMT2AMEN1MAPTTSHRLMNA
SCHEMBL188675 0.71 MAPT (0.47) KMT2AMEN1MAPTTSHRLMNA

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
CN-101353313-A Process to produce oxazolidinones UPJOHN CO (US) 2009-01-28 CN claimed
EP-1028940-B1 PROCESS TO PRODUCE OXAZOLIDINONES PHARMACIA & UPJOHN CO LLC (US) 2007-04-18 EP claimed
CN-1275122-A Process for preparing oxazolidinones UPJOHN CO (US) 2000-11-29 CN claimed