SCHEMBL8303424

SCHEMBL8303424

O=C(N[C@@H](CO)c1ccccc1)c1cccc(OCc2ccccc2)c1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GPR132 Q9UNW8 9/20 0.69
SMPD1 P17405 2/20 0.64
NR4A2 P43354 1/20 0.59
NR1H4 Q96RI1 1/20 0.57
MAOB P27338 1/20 0.56
CMKLR2 P46091 1/20 0.56
CMKLR1 Q99788 1/20 0.56
PTPN1 P18031 1/20 0.55
GUSB P08236 1/20 0.55
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
SRD5A2 P31213 1/20 0.53

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
SCHEMBL8303422 1.00 GPR132 (0.69) GPR132SMPD1NR4A2NR1H4MAOB
SCHEMBL27658913 0.85 GPR132 (0.65) GPR132SMPD1NR4A2NR1H4MAOB
SCHEMBL15232861 0.85 KMT2A (0.59) GPR132SMPD1NR4A2MAOBPTPN1
SCHEMBL27658918 0.84 GPR132 (0.64) GPR132SMPD1NR4A2NR1H4MAOB
SCHEMBL13702183 0.83 GPR132 (0.73) GPR132SMPD1NR4A2NR1H4MAOB
SCHEMBL14005611 0.83 GPR132 (0.72) GPR132SMPD1NR4A2NR1H4MAOB
SCHEMBL27658922 0.83 GPR132 (0.62) GPR132SMPD1NR4A2NR1H4MAOB
SCHEMBL1123133 0.82 GPR132 (0.77) GPR132SMPD1NR4A2NR1H4MAOB
SCHEMBL1123022 0.81 GPR132 (0.75) GPR132SMPD1NR4A2NR1H4MAOB
SCHEMBL4893620 0.81 GPR132 (0.69) GPR132SMPD1NR4A2NR1H4MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0832078-B1 N-HYDROXYUREAS AS ANTIINFLAMMATORY AGENTS PFIZER (US) 1999-10-20 EP disclosed
US-5814648-A N-hydroxyureas as antiinflammatory agents PFIZER INC. (US) 1998-09-29 US disclosed